ethyl 4-[(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)(cyclohexyl)amino]-4-oxobutanoate
Chemical Structure Depiction of
ethyl 4-[(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)(cyclohexyl)amino]-4-oxobutanoate
ethyl 4-[(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)(cyclohexyl)amino]-4-oxobutanoate
Compound characteristics
| Compound ID: | V009-6036 |
| Compound Name: | ethyl 4-[(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)(cyclohexyl)amino]-4-oxobutanoate |
| Molecular Weight: | 493.02 |
| Molecular Formula: | C23 H29 Cl N4 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(CCC(N(CCC(Nc1nnc(c2ccc(cc2)[Cl])s1)=O)C1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.724 |
| logD: | 4.7237 |
| logSw: | -4.7493 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.727 |
| InChI Key: | PKZOTXYPSXJHLU-UHFFFAOYSA-N |