N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(2,4-dimethoxyphenyl)urea
Chemical Structure Depiction of
N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(2,4-dimethoxyphenyl)urea
N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(2,4-dimethoxyphenyl)urea
Compound characteristics
| Compound ID: | E002-1304 |
| Compound Name: | N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(2,4-dimethoxyphenyl)urea |
| Molecular Weight: | 377.46 |
| Molecular Formula: | C17 H23 N5 O3 S |
| Smiles: | COc1ccc(c(c1)OC)NC(Nc1nnc(N2CCCCCC2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0311 |
| logD: | 4.031 |
| logSw: | -4.1662 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.161 |
| InChI Key: | UCAFSIFIWRJILP-UHFFFAOYSA-N |