4'-{[(3-methylphenyl)methyl]sulfanyl}-1'H-spiro[cyclohexane-1,2'-quinazoline]
Chemical Structure Depiction of
4'-{[(3-methylphenyl)methyl]sulfanyl}-1'H-spiro[cyclohexane-1,2'-quinazoline]
4'-{[(3-methylphenyl)methyl]sulfanyl}-1'H-spiro[cyclohexane-1,2'-quinazoline]
Compound characteristics
| Compound ID: | E971-0052 |
| Compound Name: | 4'-{[(3-methylphenyl)methyl]sulfanyl}-1'H-spiro[cyclohexane-1,2'-quinazoline] |
| Molecular Weight: | 336.5 |
| Molecular Formula: | C21 H24 N2 S |
| Smiles: | Cc1cccc(CSC2c3ccccc3NC3(CCCCC3)N=2)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.6887 |
| logD: | 5.6885 |
| logSw: | -5.5774 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 20.0414 |
| InChI Key: | SKDBWKGLPLQMFG-UHFFFAOYSA-N |