Basic information
- CAS
565-36-6- Standard SMILES
Nc1cccc(S(=O)(=O)Nc2ncc(Cl)cn2)c1- InChIKey
HWRUOPCDGPXWRR-UHFFFAOYSA-N- Molecular formula
- C10H9ClN4O2S
- Average molar mass
- 284.72 g/mol
- Monoisotopic mass
- 284.0134744
Overview
structure
Names & identifiers
- Preferred name
- 3-Amino-N-(5-chloro-2-pyrimidinyl)benzenesulfonamide
- IUPAC
- 3-amino-N-(5-chloropyrimidin-2-yl)benzenesulfonamide
- English name
- 3-amino-N-5-chloropyrimidin-2-ylbenzenesulphonamide
- Molecular formula
- C10H9ClN4O2S
- Molecular weight
- 284.72
Names & synonyms
Metachloridine565-36-6Benzenesulfonamide, 3-amino-N-(5-chloro-2-pyrimidinyl)-2-(m-Aminobenzenesulfonamido)-5-chloropyrimidineNSC-34646B9C4LPT2KP3-Amino-N-(5-chloro-2-pyrimidinyl)benzenesulfonamideN'-(5-chloro-2-pyrimidyl)metanilamideRefChem:911147209-277-4Metachloridin2-Metanilamido-5-chloropyrimidine
Show more names
WR-6010SN-114373-amino-N-5-chloropyrimidin-2-ylbenzenesulphonamide3-azanyl-N-(5-chloropyrimidin-2-yl)benzenesulfonamide
3-amino-N-(5-chloropyrimidin-2-yl)benzenesulfonamideWR 6010N1-(5-Chloro-2-pyrimidyl)metanilamideN'-(5-Chloro-2-pyrimidyl) metanilamideSN 11,437Metanilamide, N'-(5-chloro-2-pyrimidyl)-Metanilamide, N^1-(5-chloro-2-pyrimidinyl)-Metanilamide, N1-(5-chloro-2-pyrimidinyl)-
Database identifiers
- CAS
565-36-6、82204-92-0- PubChem CID
- 68427
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 365
Physicochemical properties
- Melting point
- 228 · 228-230 °C
- Boiling point
- 554.9 · 554.9±56.0 °C(Predicted)
- Density
- 1.588 · 1.588±0.06 g/cm3(Predicted)
- pka
- 5.56 · 5.56±0.10(Predicted)
- FDA UNII
- 9 C4LPT2KP · B9C4LPT2KP
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers1 total
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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