Propenoic acid, 3-(1-methyl-2-benzimidazolyl)-
TL;DR: Propenoic acid, 3-(1-methyl-2-benzimidazolyl)- (CAS 30769-96-1) is a chemical compound with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(1-methylbenzimidazol-2-yl)prop-2-enoic acid
Also Known As: Propenoic acid, 3-(1-methyl-2-benzimidazolyl)-, A2485/0105623, (E)-3-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylic a, (E)-3-(1-methylbenzimidazol-2-yl)prop-2-enoic acid, (2E)-3-(1-methylbenzimidazol-2-yl)prop-2-enoic acid
| Molecular Formula | C11H10N2O2 |
|---|---|
| Molecular Weight | 202.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.07423 |
| Heavy Atoms | 15 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 30769-96-1 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N=C1/C=C/C(=O)O |
| InChIKey | MFJCQRHGLKEFEG-VOTSOKGWSA-N |
Product Overview
Propenoic acid, 3-(1-methyl-2-benzimidazolyl)- (CAS 30769-96-1), with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol. IUPAC: (E)-3-(1-methylbenzimidazol-2-yl)prop-2-enoic acid.
Chemical Property Profile of Propenoic acid, 3-(1-methyl-2-benzimidazolyl)-
Property Insights of Propenoic acid, 3-(1-methyl-2-benzimidazolyl)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propenoic acid, 3-(1-methyl-2-benzimidazolyl)-. With a topological polar surface area (TPSA) of 55.1 Ų, Propenoic acid, 3-(1-methyl-2-benzimidazolyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propenoic acid, 3-(1-methyl-2-benzimidazolyl)- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Propenoic acid, 3-(1-methyl-2-benzimidazolyl)-?
The CAS number of Propenoic acid, 3-(1-methyl-2-benzimidazolyl)- is 30769-96-1.
What is the molecular formula of Propenoic acid, 3-(1-methyl-2-benzimidazolyl)-?
The molecular formula of Propenoic acid, 3-(1-methyl-2-benzimidazolyl)- is C11H10N2O2.
What is the molecular weight of Propenoic acid, 3-(1-methyl-2-benzimidazolyl)-?
The molecular weight of Propenoic acid, 3-(1-methyl-2-benzimidazolyl)- is 202.07 g/mol.
Where can I buy Propenoic acid, 3-(1-methyl-2-benzimidazolyl)-?
You can request a quote for Propenoic acid, 3-(1-methyl-2-benzimidazolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propenoic acid, 3-(1-methyl-2-benzimidazolyl)-?
Yes, KEHONG BIO provides custom synthesis services for Propenoic acid, 3-(1-methyl-2-benzimidazolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.