methyl 3-{[4-(1-propyl-1H-pyrazol-5-yl)thiophene-2-sulfonyl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[4-(1-propyl-1H-pyrazol-5-yl)thiophene-2-sulfonyl]amino}benzoate
methyl 3-{[4-(1-propyl-1H-pyrazol-5-yl)thiophene-2-sulfonyl]amino}benzoate
Compound characteristics
| Compound ID: | L924-1417 |
| Compound Name: | methyl 3-{[4-(1-propyl-1H-pyrazol-5-yl)thiophene-2-sulfonyl]amino}benzoate |
| Molecular Weight: | 405.49 |
| Molecular Formula: | C18 H19 N3 O4 S2 |
| Smiles: | CCCn1c(ccn1)c1cc(sc1)S(Nc1cccc(c1)C(=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8718 |
| logD: | 3.8522 |
| logSw: | -3.9579 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.151 |
| InChI Key: | KMPZIEIIQJJFHK-UHFFFAOYSA-N |