N-(5-chloro-2,4-dimethoxyphenyl)-N'-{1-[2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]ethyl}urea
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-N'-{1-[2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]ethyl}urea
N-(5-chloro-2,4-dimethoxyphenyl)-N'-{1-[2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]ethyl}urea
Compound characteristics
| Compound ID: | E002-1028 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-N'-{1-[2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]ethyl}urea |
| Molecular Weight: | 459.99 |
| Molecular Formula: | C23 H26 Cl N3 O3 S |
| Smiles: | CC(c1c2CCCCc2sc1n1cccc1)NC(Nc1cc(c(cc1OC)OC)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5409 |
| logD: | 5.5406 |
| logSw: | -5.8456 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.565 |
| InChI Key: | CLPRRUJXACZLHI-AWEZNQCLSA-N |