10-(2-hydroxy-5-nitrophenyl)-1,3,7,7-tetramethyl-5-phenyl-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-(2-hydroxy-5-nitrophenyl)-1,3,7,7-tetramethyl-5-phenyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
10-(2-hydroxy-5-nitrophenyl)-1,3,7,7-tetramethyl-5-phenyl-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: | D280-0384 |
Compound Name: | 10-(2-hydroxy-5-nitrophenyl)-1,3,7,7-tetramethyl-5-phenyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione |
Molecular Weight: | 476.49 |
Molecular Formula: | C25 H24 N4 O6 |
Smiles: | CC1(C)COC(c2cc(ccc2O)[N+]([O-])=O)c2c3c(C(N(C)C(N3C)=O)=O)c(c3ccccc3)n12 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.989 |
logD: | 3.2823 |
logSw: | -3.9841 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 91.232 |
InChI Key: | WDLOBTNZSVWTJW-JOCHJYFZSA-N |