ethyl 2-(4,4-diphenyl-3,4-dihydroquinazolin-2(1H)-ylidene)-3-oxoheptanoate
Chemical Structure Depiction of
ethyl 2-(4,4-diphenyl-3,4-dihydroquinazolin-2(1H)-ylidene)-3-oxoheptanoate
ethyl 2-(4,4-diphenyl-3,4-dihydroquinazolin-2(1H)-ylidene)-3-oxoheptanoate
Compound characteristics
| Compound ID: | 8018-4158 |
| Compound Name: | ethyl 2-(4,4-diphenyl-3,4-dihydroquinazolin-2(1H)-ylidene)-3-oxoheptanoate |
| Molecular Weight: | 454.57 |
| Molecular Formula: | C29 H30 N2 O3 |
| Smiles: | CCCCC(/C(=C1/Nc2ccccc2C(c2ccccc2)(c2ccccc2)N1)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6335 |
| logD: | 5.3624 |
| logSw: | -5.8314 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.651 |
| InChI Key: | XNGRKGRQPUIADM-UHFFFAOYSA-N |