5-[(4-acetylbenzene-1-sulfonyl)amino]-2-{methyl[(3-methyl-1-propyl-1H-pyrazol-5-yl)methyl]amino}benzoic acid
Chemical Structure Depiction of
5-[(4-acetylbenzene-1-sulfonyl)amino]-2-{methyl[(3-methyl-1-propyl-1H-pyrazol-5-yl)methyl]amino}benzoic acid
5-[(4-acetylbenzene-1-sulfonyl)amino]-2-{methyl[(3-methyl-1-propyl-1H-pyrazol-5-yl)methyl]amino}benzoic acid
Compound characteristics
| Compound ID: | F294-1099 |
| Compound Name: | 5-[(4-acetylbenzene-1-sulfonyl)amino]-2-{methyl[(3-methyl-1-propyl-1H-pyrazol-5-yl)methyl]amino}benzoic acid |
| Molecular Weight: | 598.6 |
| Molecular Formula: | C24 H28 N4 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCCn1c(CN(C)c2ccc(cc2C(O)=O)NS(c2ccc(cc2)C(C)=O)(=O)=O)cc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.9604 |
| logD: | 1.1283 |
| logSw: | -3.4263 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.272 |
| InChI Key: | FBZOWVACADHABW-UHFFFAOYSA-N |