methyl (4-tert-butylphenyl){4-[(2,5-dimethylfuran-3-carbonyl)amino]cyclopent-2-en-1-yl}acetate
Chemical Structure Depiction of
methyl (4-tert-butylphenyl){4-[(2,5-dimethylfuran-3-carbonyl)amino]cyclopent-2-en-1-yl}acetate
methyl (4-tert-butylphenyl){4-[(2,5-dimethylfuran-3-carbonyl)amino]cyclopent-2-en-1-yl}acetate
Compound characteristics
| Compound ID: | V013-3972 |
| Compound Name: | methyl (4-tert-butylphenyl){4-[(2,5-dimethylfuran-3-carbonyl)amino]cyclopent-2-en-1-yl}acetate |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C25 H31 N O4 |
| Smiles: | Cc1cc(C(NC2CC(C=C2)C(C(=O)OC)c2ccc(cc2)C(C)(C)C)=O)c(C)o1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.7332 |
| logD: | 5.7332 |
| logSw: | -5.4496 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.392 |
| InChI Key: | XUKDRUTTWSGJEC-UHFFFAOYSA-N |