5-(4-{[3-(azepan-1-yl)butyl]amino}-4-oxobutyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(4-{[3-(azepan-1-yl)butyl]amino}-4-oxobutyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
5-(4-{[3-(azepan-1-yl)butyl]amino}-4-oxobutyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0179 |
| Compound Name: | 5-(4-{[3-(azepan-1-yl)butyl]amino}-4-oxobutyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 473.64 |
| Molecular Formula: | C24 H35 N5 O3 S |
| Smiles: | CC(CCNC(CCCc1nnc(C(Nc2ccc(cc2)OC)=O)s1)=O)N1CCCCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6657 |
| logD: | -0.3247 |
| logSw: | -3.2335 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.886 |
| InChI Key: | MAXFEBYROSFKIP-SFHVURJKSA-N |