2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-[(4-chlorophenyl)methyl]-N-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-[(4-chlorophenyl)methyl]-N-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-[(4-chlorophenyl)methyl]-N-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K284-3952 |
| Compound Name: | 2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-[(4-chlorophenyl)methyl]-N-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 550.12 |
| Molecular Formula: | C30 H32 Cl N3 O3 S |
| Smiles: | CC(C)(C)c1ccc(CSC2=Nc3cc(ccc3C(N2Cc2ccc(cc2)[Cl])=O)C(NCCOC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.19 |
| logD: | 6.19 |
| logSw: | -6.0493 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.64 |
| InChI Key: | JVEUVEFNWNDWNR-UHFFFAOYSA-N |