1-[2-(3-fluoroanilino)-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-(3-fluoroanilino)-2-oxoethyl]-N-[(furan-2-yl)methyl]-3-(4-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
1-[2-(3-fluoroanilino)-2-oxoethyl]-N-[(furan-2-yl)methyl]-3-(4-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | C487-0068 |
| Compound Name: | 1-[2-(3-fluoroanilino)-2-oxoethyl]-N-[(furan-2-yl)methyl]-3-(4-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 526.52 |
| Molecular Formula: | C29 H23 F N4 O5 |
| Smiles: | Cc1ccc(cc1)N1C(c2ccc(cc2N(CC(Nc2cccc(c2)F)=O)C1=O)C(NCc1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1704 |
| logD: | 4.1703 |
| logSw: | -4.2959 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.967 |
| InChI Key: | LNMSKXVIWXRDDA-UHFFFAOYSA-N |