5-{[(2-{[2-(5-methyl-1H-indol-3-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[(2-{[2-(5-methyl-1H-indol-3-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-{[(2-{[2-(5-methyl-1H-indol-3-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-1181 |
| Compound Name: | 5-{[(2-{[2-(5-methyl-1H-indol-3-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 479.62 |
| Molecular Formula: | C24 H25 N5 O2 S2 |
| Smiles: | Cc1ccc2c(c1)c(CCNC(CSCc1nnc(C(Nc3ccccc3C)=O)s1)=O)c[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 3.8012 |
| logD: | 3.8011 |
| logSw: | -3.9067 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.543 |
| InChI Key: | HXHQNNTUFAKXOT-UHFFFAOYSA-N |