N-(2-chloro-4-methylphenyl)-2-[(1'H-spiro[cycloheptane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-[(1'H-spiro[cycloheptane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide
N-(2-chloro-4-methylphenyl)-2-[(1'H-spiro[cycloheptane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E971-0452 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-[(1'H-spiro[cycloheptane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide |
| Molecular Weight: | 428 |
| Molecular Formula: | C23 H26 Cl N3 O S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(CSC1c2ccccc2NC2(CCCCCC2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6598 |
| logD: | 5.6595 |
| logSw: | -5.7387 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.824 |
| InChI Key: | CUWQHFSPBIBAJO-UHFFFAOYSA-N |