[(3-cyclopentyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetonitrile
Chemical Structure Depiction of
[(3-cyclopentyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetonitrile
[(3-cyclopentyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetonitrile
Compound characteristics
| Compound ID: | 4184-0081 |
| Compound Name: | [(3-cyclopentyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetonitrile |
| Molecular Weight: | 405.56 |
| Molecular Formula: | C24 H27 N3 O S |
| Smiles: | C1CCC2(CC1)Cc1ccccc1C1=C2C(N(C2CCCC2)C(=N1)SCC#N)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7246 |
| logD: | 4.7246 |
| logSw: | -4.7503 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.9 |
| InChI Key: | LOKXDSCHLDEEMX-UHFFFAOYSA-N |