N-(5-chloro-2-methylphenyl)-2-[(1'H-spiro[cyclohexane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-2-[(1'H-spiro[cyclohexane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide
N-(5-chloro-2-methylphenyl)-2-[(1'H-spiro[cyclohexane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E971-0444 |
| Compound Name: | N-(5-chloro-2-methylphenyl)-2-[(1'H-spiro[cyclohexane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide |
| Molecular Weight: | 413.97 |
| Molecular Formula: | C22 H24 Cl N3 O S |
| Smiles: | Cc1ccc(cc1NC(CSC1c2ccccc2NC2(CCCCC2)N=1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8972 |
| logD: | 4.8968 |
| logSw: | -4.7716 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.493 |
| InChI Key: | ASHFNEKTYMFSRS-UHFFFAOYSA-N |