N-cyclopentyl-N'-{[2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methyl}urea
Chemical Structure Depiction of
N-cyclopentyl-N'-{[2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methyl}urea
N-cyclopentyl-N'-{[2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methyl}urea
Compound characteristics
| Compound ID: | E002-1479 |
| Compound Name: | N-cyclopentyl-N'-{[2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methyl}urea |
| Molecular Weight: | 343.49 |
| Molecular Formula: | C19 H25 N3 O S |
| Smiles: | C1CCC(C1)NC(NCc1c2CCCCc2sc1n1cccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5222 |
| logD: | 4.5222 |
| logSw: | -4.2806 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.252 |
| InChI Key: | CEJZLTVNMVNRJI-UHFFFAOYSA-N |