methyl 4-{[1-(3-chloro-4-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5-oxo-1-(prop-2-en-1-yl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-{[1-(3-chloro-4-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5-oxo-1-(prop-2-en-1-yl)-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-{[1-(3-chloro-4-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5-oxo-1-(prop-2-en-1-yl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
Compound ID: | 5752-2257 |
Compound Name: | methyl 4-{[1-(3-chloro-4-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5-oxo-1-(prop-2-en-1-yl)-4,5-dihydro-1H-pyrrole-3-carboxylate |
Molecular Weight: | 424.93 |
Molecular Formula: | C24 H25 Cl N2 O3 |
Smiles: | CC1=C(/C(=C/c2cc(C)n(c3ccc(C)c(c3)[Cl])c2C)C(N1CC=C)=O)C(=O)OC |
Stereo: | ACHIRAL |
logP: | 4.697 |
logD: | 4.697 |
logSw: | -4.8085 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 40.025 |
InChI Key: | SBCWABSUZDNDBP-UHFFFAOYSA-N |