N-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamothioyl]benzamide
Chemical Structure Depiction of
N-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamothioyl]benzamide
N-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamothioyl]benzamide
Compound characteristics
| Compound ID: | 3807-1489 |
| Compound Name: | N-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamothioyl]benzamide |
| Molecular Weight: | 327.42 |
| Molecular Formula: | C16 H13 N3 O S2 |
| Smiles: | C1Cc2c(C#N)c(NC(NC(c3ccccc3)=O)=S)sc2C1 |
| Stereo: | ACHIRAL |
| logP: | 3.6089 |
| logD: | 2.7472 |
| logSw: | -4.0683 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.377 |
| InChI Key: | OMXAWDLXQJAZRU-UHFFFAOYSA-N |