N-(3-chlorophenyl)-5-(4-{[3-(morpholin-4-yl)propyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-(4-{[3-(morpholin-4-yl)propyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-(4-{[3-(morpholin-4-yl)propyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0455 |
| Compound Name: | N-(3-chlorophenyl)-5-(4-{[3-(morpholin-4-yl)propyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 451.97 |
| Molecular Formula: | C20 H26 Cl N5 O3 S |
| Smiles: | C(CC(NCCCN1CCOCC1)=O)Cc1nnc(C(Nc2cccc(c2)[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.62 |
| logD: | 1.1965 |
| logSw: | -2.8181 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.261 |
| InChI Key: | RLMILGKKNDEJRP-UHFFFAOYSA-N |