N-(4-methoxyphenyl)-5-{[(3-methylbutyl)carbamamido]methyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-5-{[(3-methylbutyl)carbamamido]methyl}-1,3,4-thiadiazole-2-carboxamide
N-(4-methoxyphenyl)-5-{[(3-methylbutyl)carbamamido]methyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L062-0455 |
| Compound Name: | N-(4-methoxyphenyl)-5-{[(3-methylbutyl)carbamamido]methyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 377.46 |
| Molecular Formula: | C17 H23 N5 O3 S |
| Smiles: | CC(C)CCNC(NCc1nnc(C(Nc2ccc(cc2)OC)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3556 |
| logD: | 2.3555 |
| logSw: | -2.9301 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.933 |
| InChI Key: | KDTYPYSPZHAIKI-UHFFFAOYSA-N |