4-(3,5-dimethoxyphenyl)-6-(3-methylbutyl)-1-(prop-2-en-1-yl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Chemical Structure Depiction of
4-(3,5-dimethoxyphenyl)-6-(3-methylbutyl)-1-(prop-2-en-1-yl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
4-(3,5-dimethoxyphenyl)-6-(3-methylbutyl)-1-(prop-2-en-1-yl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Compound characteristics
| Compound ID: | V019-1347 |
| Compound Name: | 4-(3,5-dimethoxyphenyl)-6-(3-methylbutyl)-1-(prop-2-en-1-yl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C22 H29 N3 O4 |
| Smiles: | CC(C)CCN1CC2=C(C(c3cc(cc(c3)OC)OC)NC(N2CC=C)=O)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2456 |
| logD: | 3.2437 |
| logSw: | -3.598 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.052 |
| InChI Key: | BLRYWDMWGBVTLI-FQEVSTJZSA-N |