methyl 2-(3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzamido)benzoate
Chemical Structure Depiction of
methyl 2-(3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzamido)benzoate
methyl 2-(3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzamido)benzoate
Compound characteristics
| Compound ID: | 8010-8086 |
| Compound Name: | methyl 2-(3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzamido)benzoate |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C19 H17 N3 O3 S2 |
| Smiles: | Cc1nnc(SCc2cccc(c2)C(Nc2ccccc2C(=O)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.4471 |
| logD: | 2.7221 |
| logSw: | -3.8753 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.206 |
| InChI Key: | NGZGXMGMMIEDAP-UHFFFAOYSA-N |