2-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}piperazin-1-yl)-5-[(thiophene-2-sulfonyl)amino]benzoic acid
Chemical Structure Depiction of
2-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}piperazin-1-yl)-5-[(thiophene-2-sulfonyl)amino]benzoic acid
2-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}piperazin-1-yl)-5-[(thiophene-2-sulfonyl)amino]benzoic acid
Compound characteristics
| Compound ID: | F290-0619 |
| Compound Name: | 2-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}piperazin-1-yl)-5-[(thiophene-2-sulfonyl)amino]benzoic acid |
| Molecular Weight: | 466.58 |
| Molecular Formula: | C20 H26 N4 O5 S2 |
| Smiles: | CC(C)NC(CN1CCN(CC1)c1ccc(cc1C(O)=O)NS(c1cccs1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5697 |
| logD: | 0.4541 |
| logSw: | -3.0447 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.724 |
| InChI Key: | RJKAFVYMRVVMEM-UHFFFAOYSA-N |