Basic information
- CAS
22199-93-5- Standard SMILES
Cl.Nc1nccc(Nc2ccc(S(N)(=O)=O)cc2)n1- InChIKey
AJQQWYVKGSZKFW-UHFFFAOYSA-N- Molecular formula
- C10H12ClN5O2S
- Average molar mass
- 301.75 g/mol
- Monoisotopic mass
- 301.0400235
Names & identifiers
- Preferred name
- 4-(2-Amino-4-pyrimidylamino)benzenesulfonamide hydrochloride
- IUPAC
- 4-[(2-aminopyrimidin-4-yl)amino]benzenesulfonamide;hydrochloride
- English name
- 4-[(2-aminopyrimidin-4-yl)amino]benzene-1-sulfonamide hydrochloride
- Molecular formula
- C10H12ClN5O2S
- Molecular weight
- 301.75
Names & synonyms
22199-93-59V6OFB7KKZNSC-683526UNII-9V6OFB7KKZ4-(2-Amino-4-pyrimidylamino)benzenesulfonamide, hydrochloride4-(2-AMINO-4-PYRIMIDYLAMINO)BENZENESULFONAMIDE HYDROCHLORIDEBenzenesulfonamide, 4-((2-amino-4-pyrimidinyl)amino)-, hydrochloride (1:1)RefChem:1985564-[(2-aminopyrimidin-4-yl)amino]benzene-1-sulfonamide hydrochloride4-((2-Aminopyrimidin-4-yl)amino)benzenesulfonamide hydrochlorideMFCD000127844-[(2-aminopyrimidin-4-yl)amino]benzenesulfonamide;hydrochloride
Show more names
4-((2-aminopyrimidine-4-yl)amino)benzenesulfonylamidehydrochloride
NSC6835264-[(2-aminopyrimidin-4-yl)amino]benzenesulfonamide hydrochlorideSCHEMBL6474750AJQQWYVKGSZKFW-UHFFFAOYSA-NXAA19993AKOS008056284EBC-179179AS-94841
Database identifiers
- CAS
Properties
Computed structural properties
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 361
Physicochemical properties
- FDA UNII
- 9 V6OFB7KKZ · 9V6OFB7KKZ
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers7 total
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海玉函化工有限公司021-61469567 13774476675 · [email protected]
上海腾骞生物科技有限公司021-50895067 18616507272;13681616114;15020344067 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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