N-(butan-2-yl)-N-(3-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2-phenylbutanamide
Chemical Structure Depiction of
N-(butan-2-yl)-N-(3-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2-phenylbutanamide
N-(butan-2-yl)-N-(3-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2-phenylbutanamide
Compound characteristics
| Compound ID: | V025-3080 |
| Compound Name: | N-(butan-2-yl)-N-(3-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2-phenylbutanamide |
| Molecular Weight: | 485.05 |
| Molecular Formula: | C25 H29 Cl N4 O2 S |
| Salt: | not_available |
| Smiles: | CCC(C(N(CCC(Nc1nnc(c2cccc(c2)[Cl])s1)=O)C(C)CC)=O)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.2677 |
| logD: | 6.2674 |
| logSw: | -6.1089 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.179 |
| InChI Key: | BHBZXKOSLOQHRK-UHFFFAOYSA-N |