5-(4-tert-butylphenyl)-6-cycloheptyl-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
5-(4-tert-butylphenyl)-6-cycloheptyl-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
5-(4-tert-butylphenyl)-6-cycloheptyl-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | D077-0142 |
| Compound Name: | 5-(4-tert-butylphenyl)-6-cycloheptyl-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 407.56 |
| Molecular Formula: | C25 H33 N3 O2 |
| Smiles: | CC(C)(C)c1ccc(cc1)c1c2C(N(C)C(N(C)c2cn1C1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0877 |
| logD: | 6.0877 |
| logSw: | -5.3858 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.951 |
| InChI Key: | HDLVDLDURBCRRL-UHFFFAOYSA-N |