N-(butan-2-yl)-N-(3-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)heptanamide
Chemical Structure Depiction of
N-(butan-2-yl)-N-(3-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)heptanamide
N-(butan-2-yl)-N-(3-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)heptanamide
Compound characteristics
| Compound ID: | V026-4205 |
| Compound Name: | N-(butan-2-yl)-N-(3-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)heptanamide |
| Molecular Weight: | 451.03 |
| Molecular Formula: | C22 H31 Cl N4 O2 S |
| Salt: | not_available |
| Smiles: | CCCCCCC(N(CCC(Nc1nnc(c2cccc(c2)[Cl])s1)=O)C(C)CC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3258 |
| logD: | 6.3255 |
| logSw: | -6.0389 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.923 |
| InChI Key: | DDRWPGUECIWOAN-INIZCTEOSA-N |