1-tert-butyl-5-(4-chlorophenyl)-4-(3,4,5-trimethoxyphenyl)-4,4a,5,7-tetrahydroimidazo[4,5-b]pyrazolo[4,3-e]pyridin-6(1H)-one
Chemical Structure Depiction of
1-tert-butyl-5-(4-chlorophenyl)-4-(3,4,5-trimethoxyphenyl)-4,4a,5,7-tetrahydroimidazo[4,5-b]pyrazolo[4,3-e]pyridin-6(1H)-one
1-tert-butyl-5-(4-chlorophenyl)-4-(3,4,5-trimethoxyphenyl)-4,4a,5,7-tetrahydroimidazo[4,5-b]pyrazolo[4,3-e]pyridin-6(1H)-one
Compound characteristics
| Compound ID: | 8020-5320 |
| Compound Name: | 1-tert-butyl-5-(4-chlorophenyl)-4-(3,4,5-trimethoxyphenyl)-4,4a,5,7-tetrahydroimidazo[4,5-b]pyrazolo[4,3-e]pyridin-6(1H)-one |
| Molecular Weight: | 509.99 |
| Molecular Formula: | C26 H28 Cl N5 O4 |
| Smiles: | CC(C)(C)n1c2c(cn1)C(C1C(NC(N1c1ccc(cc1)[Cl])=O)=N2)c1cc(c(c(c1)OC)OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5318 |
| logD: | 4.5311 |
| logSw: | -4.7822 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.768 |
| InChI Key: | LTNLBASMJBABCR-UHFFFAOYSA-N |