N-(3-chloro-4-methylphenyl)-2-[(1'H-spiro[cycloheptane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-[(1'H-spiro[cycloheptane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide
N-(3-chloro-4-methylphenyl)-2-[(1'H-spiro[cycloheptane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E971-0403 |
| Compound Name: | N-(3-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(cc1[Cl])NC(CSC1c2ccccc2NC2(CCCCCC2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3262 |
| logD: | 6.3258 |
| logSw: | -5.9506 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.522 |
| InChI Key: | KCCIPOWDYVGVEX-UHFFFAOYSA-N |