5-(2-methylpropyl)-N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(2-methylpropyl)-N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
5-(2-methylpropyl)-N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F735-0879 |
| Compound Name: | 5-(2-methylpropyl)-N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 429.58 |
| Molecular Formula: | C22 H31 N5 O2 S |
| Smiles: | CC(C)Cc1nnc(C(Nc2ccc(cc2)C(NCCC(C)N2CCCC2)=O)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8975 |
| logD: | -0.4971 |
| logSw: | -3.5186 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.59 |
| InChI Key: | KQCZGOBVFAAGQF-INIZCTEOSA-N |