5-[(5-chloro-2-methoxybenzene-1-sulfonyl)amino]-2-[4-(ethoxycarbonyl)piperazin-1-yl]benzoic acid
Chemical Structure Depiction of
5-[(5-chloro-2-methoxybenzene-1-sulfonyl)amino]-2-[4-(ethoxycarbonyl)piperazin-1-yl]benzoic acid
5-[(5-chloro-2-methoxybenzene-1-sulfonyl)amino]-2-[4-(ethoxycarbonyl)piperazin-1-yl]benzoic acid
Compound characteristics
| Compound ID: | F290-0213 |
| Compound Name: | 5-[(5-chloro-2-methoxybenzene-1-sulfonyl)amino]-2-[4-(ethoxycarbonyl)piperazin-1-yl]benzoic acid |
| Molecular Weight: | 497.95 |
| Molecular Formula: | C21 H24 Cl N3 O7 S |
| Smiles: | CCOC(N1CCN(CC1)c1ccc(cc1C(O)=O)NS(c1cc(ccc1OC)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5889 |
| logD: | 1.4732 |
| logSw: | -3.9202 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.858 |
| InChI Key: | ZTDYJHSABGJKKP-UHFFFAOYSA-N |