ethyl 1-[3-({2-[(4-methylbenzene-1-sulfonyl)imino]-1,3-thiazol-3(2H)-yl}methyl)benzoyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-({2-[(4-methylbenzene-1-sulfonyl)imino]-1,3-thiazol-3(2H)-yl}methyl)benzoyl]piperidine-4-carboxylate
ethyl 1-[3-({2-[(4-methylbenzene-1-sulfonyl)imino]-1,3-thiazol-3(2H)-yl}methyl)benzoyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V014-0382 |
| Compound Name: | ethyl 1-[3-({2-[(4-methylbenzene-1-sulfonyl)imino]-1,3-thiazol-3(2H)-yl}methyl)benzoyl]piperidine-4-carboxylate |
| Molecular Weight: | 527.66 |
| Molecular Formula: | C26 H29 N3 O5 S2 |
| Smiles: | CCOC(C1CCN(CC1)C(c1cccc(CN2C=CSC/2=N/S(c2ccc(C)cc2)(=O)=O)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2492 |
| logD: | 3.2492 |
| logSw: | -3.3184 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 80.574 |
| InChI Key: | LWVIEPWEXBEFAM-UHFFFAOYSA-N |