1'-(4-chlorobenzoyl)-5',6',7',8'-tetrahydro-1'H-spiro[cyclohexane-1,2'-quinazolin]-4'(3'H)-one
Chemical Structure Depiction of
1'-(4-chlorobenzoyl)-5',6',7',8'-tetrahydro-1'H-spiro[cyclohexane-1,2'-quinazolin]-4'(3'H)-one
1'-(4-chlorobenzoyl)-5',6',7',8'-tetrahydro-1'H-spiro[cyclohexane-1,2'-quinazolin]-4'(3'H)-one
Compound characteristics
| Compound ID: | D070-0005 |
| Compound Name: | 1'-(4-chlorobenzoyl)-5',6',7',8'-tetrahydro-1'H-spiro[cyclohexane-1,2'-quinazolin]-4'(3'H)-one |
| Molecular Weight: | 358.87 |
| Molecular Formula: | C20 H23 Cl N2 O2 |
| Smiles: | C1CCC2(CC1)NC(C1CCCCC=1N2C(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8487 |
| logD: | 3.8443 |
| logSw: | -4.5102 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.333 |
| InChI Key: | BFEDMQVFVSPRIR-UHFFFAOYSA-N |