10-(2H-1,3-benzodioxol-5-yl)-5-(4-chlorophenyl)-1,3-dimethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Chemical Structure Depiction of
10-(2H-1,3-benzodioxol-5-yl)-5-(4-chlorophenyl)-1,3-dimethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
10-(2H-1,3-benzodioxol-5-yl)-5-(4-chlorophenyl)-1,3-dimethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Compound characteristics
| Compound ID: | D280-0161 |
| Compound Name: | 10-(2H-1,3-benzodioxol-5-yl)-5-(4-chlorophenyl)-1,3-dimethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione |
| Molecular Weight: | 465.89 |
| Molecular Formula: | C24 H20 Cl N3 O5 |
| Smiles: | CN1C(c2c(c3C(c4ccc5c(c4)OCO5)OCCn3c2c2ccc(cc2)[Cl])N(C)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5798 |
| logD: | 4.5798 |
| logSw: | -5.1682 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.495 |
| InChI Key: | KTXRVTDPRKQTBW-JOCHJYFZSA-N |