3-[(4-Anilino-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]benzoic acid
3-[(4-anilino-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]benzoic acid
Also Known As: ChemDiv3_005347|IDI1_023257|3-[(4-anilino-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]benzoic acid|AN-648/25106044|BRD-K85128079-001-01-6|3-{[4-(phenylamino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]amino}benzoic acid|3-{[4-anilino-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino}benzoic acid|3-{[4-(phenylamino)-6-pyrrolidinyl-1,3,5-triazin-2-yl]amino}benzoic acid|3-((4-(Phenylamino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl)amino)benzoic acid
| Molecular Formula | C20H20N6O2 |
|---|---|
| Molecular Weight | 376.16476 g/mol |
| LogP | 3.6572 |
| Topological Polar Surface Area | 103.27 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 376.16476 |
| Monoisotopic Mass | 376.16476 |
| Heavy Atoms | 28 |
| Complexity | 973.43976 |
Chemical Identifiers
| CAS Number | 433698-74-9 |
|---|---|
| SMILES | C1CCN(C1)C2=NC(=NC(=N2)NC3=CC=CC(=C3)C(=O)O)NC4=CC=CC=C4 |
Product Overview
3-[(4-Anilino-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]benzoic acid (CAS 433698-74-9), with molecular formula C20H20N6O2 and molecular weight 376.16476 g/mol. IUPAC: 3-[(4-anilino-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]benzoic acid.