3-(cyclohexylmethyl)-2-(methylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Chemical Structure Depiction of
3-(cyclohexylmethyl)-2-(methylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
3-(cyclohexylmethyl)-2-(methylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Compound characteristics
| Compound ID: | 4184-0114 |
| Compound Name: | 3-(cyclohexylmethyl)-2-(methylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one |
| Molecular Weight: | 394.58 |
| Molecular Formula: | C24 H30 N2 O S |
| Smiles: | CSC1=NC2=C(C(N1CC1CCCCC1)=O)C1(CCCC1)Cc1ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 6.076 |
| logD: | 6.076 |
| logSw: | -5.4693 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.3788 |
| InChI Key: | VUQPOCBIHSYKCQ-UHFFFAOYSA-N |