1-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-N-[(furan-2-yl)methyl]-3-(4-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
1-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-N-[(furan-2-yl)methyl]-3-(4-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
1-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-N-[(furan-2-yl)methyl]-3-(4-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | C487-0052 |
| Compound Name: | 1-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-N-[(furan-2-yl)methyl]-3-(4-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 540.62 |
| Molecular Formula: | C31 H32 N4 O5 |
| Smiles: | Cc1ccc(cc1)N1C(c2ccc(cc2N(CC(NCCC2CCCCC=2)=O)C1=O)C(NCc1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.74 |
| logD: | 3.7399 |
| logSw: | -3.9025 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.323 |
| InChI Key: | ZSNCSVIMQGFPGT-UHFFFAOYSA-N |