Basic information
- CAS
327077-32-7- Standard SMILES
Nc1nc2c(s1)CN(Cc1ccccc1)CC2- InChIKey
MEEFMSOSTHOISQ-UHFFFAOYSA-N- Molecular formula
- C13H15N3S
- Average molar mass
- 245.35 g/mol
- Monoisotopic mass
- 245.09866866
Names & identifiers
- Preferred name
- 5-Benzyl-4,5,6,7-tetrahydro-thiazolo[5,4-c]pyridin-2-ylamine
- IUPAC
- 5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine
- English name
- 5-BENZYL-4,5,6,7-TETRAHYDRO-THIAZOLO[5,4-C]PYRIDIN-2-YLAMINE
- Molecular formula
- C13H15N3S
- Molecular weight
- 245.34
Names & synonyms
327077-32-75-Benzyl-4,5,6,7-tetrahydro-thiazolo[5,4-c]pyridin-2-ylamine5-Benzyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridin-2-amineMFCD026541775-benzyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-{c}]pyridin-2-amine5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine5-Benzyl-4,5,6,7-tetrahydro-thiazolo-[5,4-c]pyridin-2-ylamine5-benzyl-4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridin-2-amineF0916-15755-Benzyl-4,5,6,7-tetrahydrothiazolo-5,4-c]pyridin-2-ylamine5-benzyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-amineOprea1_011549
Show more names
TIMTEC-BB SBB011872OTAVA-BB BB7212060151Thiazolo[5,4-c]pyridin-2-amine, 4,5,6,7-tetrahydro-5-(phenylmethyl)-
Oprea1_077575SCHEMBL17934007DTXSID10354642SMSSF-0015448ALBB-006720NSC806401SBB011872AKOS000115438
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 70.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 255
Physicochemical properties
- Boiling point
- 414.1 · 414.1±40.0 °C(Predicted)
- Density
- 1.287 · 1.287±0.06 g/cm3(Predicted)
- pka
- 5.97 · 5.97±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Suppliers7 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
苏州亚衍医药科技有限公司17715136450 · [email protected]
苏州施亚生物科技有限公司86(512)5235 8471 17715136450 · [email protected]
北京伊诺凯科技有限公司15652467323 · [email protected]
华诺医药科技(广西)有限公司13005928603 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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