propan-2-yl 4-[3-(3,3-dimethylbutanamido)phenyl]-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
propan-2-yl 4-[3-(3,3-dimethylbutanamido)phenyl]-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
propan-2-yl 4-[3-(3,3-dimethylbutanamido)phenyl]-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V027-8099 |
| Compound Name: | propan-2-yl 4-[3-(3,3-dimethylbutanamido)phenyl]-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 401.51 |
| Molecular Formula: | C22 H31 N3 O4 |
| Smiles: | CC(C)OC(C1C(c2cccc(c2)NC(CC(C)(C)C)=O)NC(N(C)C=1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7242 |
| logD: | 3.7198 |
| logSw: | -3.9389 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.257 |
| InChI Key: | CNRVWMZGNIJBRZ-IBGZPJMESA-N |