1-{[1,3-dimethyl-7-(3-methylbutyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-{[1,3-dimethyl-7-(3-methylbutyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperidine-4-carboxamide
1-{[1,3-dimethyl-7-(3-methylbutyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C470-0646 |
| Compound Name: | 1-{[1,3-dimethyl-7-(3-methylbutyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperidine-4-carboxamide |
| Molecular Weight: | 390.48 |
| Molecular Formula: | C19 H30 N6 O3 |
| Smiles: | CC(C)CCn1c2C(N(C)C(N(C)c2nc1CN1CCC(CC1)C(N)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3228 |
| logD: | 0.6378 |
| logSw: | -1.2842 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.722 |
| InChI Key: | IOCDTSBNIYANHP-UHFFFAOYSA-N |