N-{5-[butyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(5-chloro-2,4-dimethoxyphenyl)urea
Chemical Structure Depiction of
N-{5-[butyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(5-chloro-2,4-dimethoxyphenyl)urea
N-{5-[butyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(5-chloro-2,4-dimethoxyphenyl)urea
Compound characteristics
| Compound ID: | E002-1408 |
| Compound Name: | N-{5-[butyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(5-chloro-2,4-dimethoxyphenyl)urea |
| Molecular Weight: | 399.9 |
| Molecular Formula: | C16 H22 Cl N5 O3 S |
| Smiles: | CCCCN(C)c1nnc(NC(Nc2cc(c(cc2OC)OC)[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.1583 |
| logD: | 4.1575 |
| logSw: | -4.5048 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.669 |
| InChI Key: | BUYSBUJLDREHAW-UHFFFAOYSA-N |