N-(3-ethoxypropyl)-N'-{1-[2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]ethyl}urea
Chemical Structure Depiction of
N-(3-ethoxypropyl)-N'-{1-[2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]ethyl}urea
N-(3-ethoxypropyl)-N'-{1-[2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]ethyl}urea
Compound characteristics
| Compound ID: | E002-1011 |
| Compound Name: | N-(3-ethoxypropyl)-N'-{1-[2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]ethyl}urea |
| Molecular Weight: | 375.53 |
| Molecular Formula: | C20 H29 N3 O2 S |
| Smiles: | CCOCCCNC(NC(C)c1c2CCCCc2sc1n1cccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9244 |
| logD: | 3.9244 |
| logSw: | -3.8123 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.415 |
| InChI Key: | FOLUKVXLOLLXII-HNNXBMFYSA-N |