7-bromo-6-ethyl-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
7-bromo-6-ethyl-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
7-bromo-6-ethyl-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
Compound ID: | 8013-0800 |
Compound Name: | 7-bromo-6-ethyl-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
Molecular Weight: | 362.22 |
Molecular Formula: | C16 H16 Br N3 O2 |
Smiles: | CCn1c(c2ccccc2)c2C(N(C)C(N(C)c2c1[Br])=O)=O |
Stereo: | ACHIRAL |
logP: | 3.2285 |
logD: | 3.2285 |
logSw: | -3.3291 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 33.229 |
InChI Key: | HIKXTSMZULWWSN-UHFFFAOYSA-N |