N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(5-chloro-2-methoxyphenyl)urea
Chemical Structure Depiction of
N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(5-chloro-2-methoxyphenyl)urea
N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(5-chloro-2-methoxyphenyl)urea
Compound characteristics
| Compound ID: | E002-0310 |
| Compound Name: | N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(5-chloro-2-methoxyphenyl)urea |
| Molecular Weight: | 381.88 |
| Molecular Formula: | C16 H20 Cl N5 O2 S |
| Smiles: | COc1ccc(cc1NC(Nc1nnc(N2CCCCCC2)s1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5387 |
| logD: | 4.5383 |
| logSw: | -4.731 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.617 |
| InChI Key: | GMQRUOQKVYPAHV-UHFFFAOYSA-N |