AC1MERT6
3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Also Known As: TimTec1_004475|Oprea1_012487|Oprea1_805650|BAS 00821008|AG-205/37175048|2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid|3-((3,4-dimethoxyphenethyl)carbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid|3-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid|3-{N-[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}bicyclo[2.2.1]hept-5-ene-2-carbox ylic acid|3-({[2-(3,4-dimethoxyphenyl)ethyl]amino}carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid|3-{[(3,4-DIMETHOXYPHENETHYL)AMINO]CARBONYL}BICYCLO[2.2.1]HEPT-5-ENE-2-CARBOXYLIC ACID
| Molecular Formula | C19H23NO5 |
|---|---|
| Molecular Weight | 345.15762 g/mol |
| LogP | 1.8854 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 345.15762 |
| Monoisotopic Mass | 345.15762 |
| Heavy Atoms | 25 |
| Complexity | 699.05493 |
Chemical Identifiers
| CAS Number | 355403-83-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC(=O)C2C3CC(C2C(=O)O)C=C3)OC |
Product Overview
AC1MERT6 (CAS 355403-83-7), with molecular formula C19H23NO5 and molecular weight 345.15762 g/mol. IUPAC: 3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid.