N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(3,5-dimethoxyphenyl)urea
Chemical Structure Depiction of
N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(3,5-dimethoxyphenyl)urea
N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(3,5-dimethoxyphenyl)urea
Compound characteristics
| Compound ID: | E002-1302 |
| Compound Name: | N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(3,5-dimethoxyphenyl)urea |
| Molecular Weight: | 377.46 |
| Molecular Formula: | C17 H23 N5 O3 S |
| Smiles: | COc1cc(cc(c1)OC)NC(Nc1nnc(N2CCCCCC2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.424 |
| logD: | 4.424 |
| logSw: | -4.1862 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.772 |
| InChI Key: | MHTDRBAXBXXIGJ-UHFFFAOYSA-N |