3-[(2,1,3-benzoxadiazol-5-yl)methyl]-7-methyl-1-phenyl-5-(piperidine-1-carbonyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[(2,1,3-benzoxadiazol-5-yl)methyl]-7-methyl-1-phenyl-5-(piperidine-1-carbonyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione
3-[(2,1,3-benzoxadiazol-5-yl)methyl]-7-methyl-1-phenyl-5-(piperidine-1-carbonyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | J026-3004 |
| Compound Name: | 3-[(2,1,3-benzoxadiazol-5-yl)methyl]-7-methyl-1-phenyl-5-(piperidine-1-carbonyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 496.53 |
| Molecular Formula: | C27 H24 N6 O4 |
| Smiles: | Cc1cc(C(N2CCCCC2)=O)c2C(N(Cc3ccc4c(c3)non4)C(N(c3ccccc3)c2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1202 |
| logD: | 4.1201 |
| logSw: | -4.2991 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 92.328 |
| InChI Key: | DTJXDLMOIXUZOI-UHFFFAOYSA-N |