N-(3-fluorophenyl)-5-{[(2-{[2-(morpholin-4-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-fluorophenyl)-5-{[(2-{[2-(morpholin-4-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
N-(3-fluorophenyl)-5-{[(2-{[2-(morpholin-4-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0987 |
| Compound Name: | N-(3-fluorophenyl)-5-{[(2-{[2-(morpholin-4-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 439.53 |
| Molecular Formula: | C18 H22 F N5 O3 S2 |
| Smiles: | C(CN1CCOCC1)NC(CSCc1nnc(C(Nc2cccc(c2)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3005 |
| logD: | 1.2668 |
| logSw: | -2.3208 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.261 |
| InChI Key: | ICRPOYAWRUBDSZ-UHFFFAOYSA-N |