N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-cyclohexyl-2-imino-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-cyclohexyl-2-imino-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-cyclohexyl-2-imino-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | Y070-3284 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-cyclohexyl-2-imino-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide |
| Molecular Weight: | 485.54 |
| Molecular Formula: | C27 H27 N5 O4 |
| Smiles: | CC1=CC=CN2C1=NC1=C(C=C(C(=N)N1C1CCCCC1)C(NCc1ccc3c(c1)OCO3)=O)C2=O |
| Stereo: | ACHIRAL |
| logP: | 2.9442 |
| logD: | 2.9376 |
| logSw: | -3.2085 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.04 |
| InChI Key: | HTHRSWPAOSLAJM-UHFFFAOYSA-N |