N-benzyl-N~3~-[2-(4-methoxyphenyl)quinazolin-4-yl]-N~3~-(2-phenylethyl)-beta-alaninamide
Chemical Structure Depiction of
N-benzyl-N~3~-[2-(4-methoxyphenyl)quinazolin-4-yl]-N~3~-(2-phenylethyl)-beta-alaninamide
N-benzyl-N~3~-[2-(4-methoxyphenyl)quinazolin-4-yl]-N~3~-(2-phenylethyl)-beta-alaninamide
Compound characteristics
| Compound ID: | V001-4477 |
| Compound Name: | N-benzyl-N~3~-[2-(4-methoxyphenyl)quinazolin-4-yl]-N~3~-(2-phenylethyl)-beta-alaninamide |
| Molecular Weight: | 516.64 |
| Molecular Formula: | C33 H32 N4 O2 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)c1nc(c2ccccc2n1)N(CCC(NCc1ccccc1)=O)CCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.0986 |
| logD: | 6.6573 |
| logSw: | -6.0327 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.902 |
| InChI Key: | WTWFHYPKOOLSEA-UHFFFAOYSA-N |