Basic information
- CAS
1246094-78-9- Standard SMILES
Cl.NC(=O)Nc1cc(-c2cccc(F)c2)sc1C(=O)N[C@H]1CCCNC1- InChIKey
WFZBLOIXZRZEDG-YDALLXLXSA-N- Molecular formula
- C17H20ClFN4O2S
- Average molar mass
- 398.9 g/mol
- Monoisotopic mass
- 398.0979529
Names & identifiers
- Preferred name
- (S)-5-(3-Fluorophenyl)-N-(piperidin-3-yl)-3-ureidothiophene-2-carboxamide hydrochloride
- IUPAC
- 3-(carbamoylamino)-5-(3-fluorophenyl)-N-[(3S)-piperidin-3-yl]thiophene-2-carboxamide;hydrochloride
- English name
- AZD 7762 hydrochloride
- Molecular formula
- C17H20ClFN4O2S
- Molecular weight
- 398.88
Names & synonyms
1246094-78-9AZD 7762 hydrochloride(S)-5-(3-Fluorophenyl)-N-(piperidin-3-yl)-3-ureidothiophene-2-carboxamide hydrochlorideAZD-7762 hydrochlorideAZD7762 hydrochlorideAZD-7762 (hydrochloride)AZD-7762 HCl3-(carbamoylamino)-5-(3-fluorophenyl)-N-[(3S)-piperidin-3-yl]thiophene-2-carboxamide;hydrochlorideC17H20ClFN4O2SMFCD12546135MLS006010750SCHEMBL19457662
Show more names
AZD7762 HClAZD7762 HCl,AZD-7762 HClAZD-7762 hydrochloride ≥95%AZD-7762 hydrochloride >=98% (HPLC)5-(3-Fluorophenyl)-3-ureidothiophene-2-carboxylic acid N-[(S)-piperidin-3-yl]amide hydrochloride3-[(Aminocarbonyl)amino]-5-(3-fluorophenyl)-N-(3S)-3-piperidinyl-2-thiophenecarboxamide hydrochloride
SCHEMBL29994838GLXC-07052HY-10992AAKOS024458535DA-61371SMR004701703AZD-7762 hydrochloride, >=98% (HPLC)CS-0019755
Properties
Computed structural properties
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 495
Physicochemical properties
- storage temp.
- -20 °C · -20°C
- solubility
- 15 mg/mL, · DMSO: soluble15mg/mL, clear
- form
- powder
- color
- white to light brown
- InChIKey
- WFZBLOIXZRZEDG-YDALLXLXSA-N
- SMILES
- Cl.NC(=O)Nc1cc(sc1C(=O)N[C@H]2CCCNC2)-c3cccc(F)c3
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 77 · NA.77
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H318
- Precautionary statements
- 280 · P280-P301+P312+P330-P305+P351+P338+P310
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-41
- Safety Statements
- 26 · 26-39
- WGK Germany
- 3 · 3
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- risk_code
- 22-41
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_code
- Xn
- safety_code
- 26-39
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H318
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1
- Precautionary statements
- P280-P301+P312+P330-P305+P351+P338+P310
Chemistry & industry
Applications
UsesAZD 7762 Hydrochloride is a checkpoint kinase inhibitor (CHK1 and CHK2); these checkpoints are responsible for responding to DNA damage that results in cell cycle arrest.
Suppliers23 total
United Life Science020-82099279 18988968278 · [email protected]
InvivoChem中国13549236410 · [email protected]
上海瀚香生物科技有限公司177-54423994 17754423994 · [email protected]
上海楼岚生物科技有限公司021-52996696，15000506266 15000506266
BOC Sciences16314854226; +8616314854226 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
风咏生物（AbMole）021-10000000 13000000000 · [email protected]
药渡经纬信息科技(北京)有限公司+86-400-851-9921 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海超岚化工科技中心QQ：65489617 13301690235 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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