1,3-dimethyl-6-{4-[4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanoyl]piperazin-1-yl}pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1,3-dimethyl-6-{4-[4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanoyl]piperazin-1-yl}pyrimidine-2,4(1H,3H)-dione
1,3-dimethyl-6-{4-[4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanoyl]piperazin-1-yl}pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L329-0312 |
| Compound Name: | 1,3-dimethyl-6-{4-[4-(6-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanoyl]piperazin-1-yl}pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 455.51 |
| Molecular Formula: | C23 H29 N5 O5 |
| Smiles: | Cc1ccc2c(c1)N(CCCC(N1CCN(CC1)C1=CC(N(C)C(N1C)=O)=O)=O)C(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5144 |
| logD: | 0.5144 |
| logSw: | -1.5634 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.733 |
| InChI Key: | FBVBKWXOBSDOSA-UHFFFAOYSA-N |