N-[4-(propan-2-yl)phenyl]-2-[(1'H-spiro[cycloheptane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[4-(propan-2-yl)phenyl]-2-[(1'H-spiro[cycloheptane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide
N-[4-(propan-2-yl)phenyl]-2-[(1'H-spiro[cycloheptane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E971-0214 |
| Compound Name: | N-[4-(propan-2-yl)phenyl]-2-[(1'H-spiro[cycloheptane-1,2'-quinazolin]-4'-yl)sulfanyl]acetamide |
| Molecular Weight: | 421.6 |
| Molecular Formula: | C25 H31 N3 O S |
| Smiles: | CC(C)c1ccc(cc1)NC(CSC1c2ccccc2NC2(CCCCCC2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2742 |
| logD: | 6.274 |
| logSw: | -5.317 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.522 |
| InChI Key: | ZUASPLAJRFVIHY-UHFFFAOYSA-N |