N-[(2,4-difluorophenyl)methyl]-2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
Chemical Structure Depiction of
N-[(2,4-difluorophenyl)methyl]-2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
N-[(2,4-difluorophenyl)methyl]-2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide
Compound characteristics
| Compound ID: | F796-0637 |
| Compound Name: | N-[(2,4-difluorophenyl)methyl]-2-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetamide |
| Molecular Weight: | 428.39 |
| Molecular Formula: | C21 H18 F2 N4 O4 |
| Smiles: | COc1cc2c3c(C(N(CC(NCc4ccc(cc4F)F)=O)C=N3)=O)[nH]c2cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.7182 |
| logD: | 1.7182 |
| logSw: | -2.3932 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.029 |
| InChI Key: | HSDSIFUFKQWTQL-UHFFFAOYSA-N |