methyl N-({[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)-S-benzylcysteinate
Chemical Structure Depiction of
methyl N-({[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)-S-benzylcysteinate
methyl N-({[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)-S-benzylcysteinate
Compound characteristics
| Compound ID: | 8017-5723 |
| Compound Name: | methyl N-({[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)-S-benzylcysteinate |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C20 H24 N4 O4 S2 |
| Smiles: | COC(C(CSCc1ccccc1)NC(CSC1=NC(C=C(N)N1CC=C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2606 |
| logD: | 1.2606 |
| logSw: | -2.019 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.339 |
| InChI Key: | GKAJCMBVOWVLKO-HNNXBMFYSA-N |