N-[(2-chlorophenyl)methyl]-1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-3-(4-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-3-(4-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-[(2-chlorophenyl)methyl]-1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-3-(4-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | C487-0115 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-3-(4-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 557.01 |
| Molecular Formula: | C30 H25 Cl N4 O5 |
| Smiles: | Cc1ccc(cc1)N1C(c2ccc(cc2N(CC(NCc2ccco2)=O)C1=O)C(NCc1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3768 |
| logD: | 4.3768 |
| logSw: | -4.4591 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.289 |
| InChI Key: | AGTJDTGLSKBLLH-UHFFFAOYSA-N |