5-[(ethanesulfonyl)amino]-2-(4-{2-[(2-methoxyethyl)amino]-2-oxoethyl}piperazin-1-yl)benzoic acid
Chemical Structure Depiction of
5-[(ethanesulfonyl)amino]-2-(4-{2-[(2-methoxyethyl)amino]-2-oxoethyl}piperazin-1-yl)benzoic acid
5-[(ethanesulfonyl)amino]-2-(4-{2-[(2-methoxyethyl)amino]-2-oxoethyl}piperazin-1-yl)benzoic acid
Compound characteristics
| Compound ID: | F290-0686 |
| Compound Name: | 5-[(ethanesulfonyl)amino]-2-(4-{2-[(2-methoxyethyl)amino]-2-oxoethyl}piperazin-1-yl)benzoic acid |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C18 H28 N4 O6 S |
| Smiles: | CCS(Nc1ccc(c(c1)C(O)=O)N1CCN(CC1)CC(NCCOC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9618 |
| logD: | -1.1539 |
| logSw: | -2.4042 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 110.814 |
| InChI Key: | ZRHXVNJNVJXNBU-UHFFFAOYSA-N |