Benzimidazole urea analogue, 10
TL;DR: Benzimidazole urea analogue, 10 (CAS 636581-12-9) is a chemical compound with molecular formula C17H17N5O3 and molecular weight 339.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(ethylcarbamoylamino)-6-pyridin-3-yl-1H-benzimidazole-4-carboxylate
Also Known As: Benzimidazole urea analogue, 10, methyl 2-(3-ethylureido)-5-(pyridine-3-yl)-1H-benzo[d]imidazole-3-carboxylate, Methyl 2-(ethylcarbamoylamino)-6-pyridin-3-yl-1H-benzoimidazole-4-carboxylate, methyl 2-[(ethylcarbamoyl)amino]-5-(pyridin-3-yl)-1H-1,3-benzodiazole-7-carboxylate
| Molecular Formula | C17H17N5O3 |
|---|---|
| Molecular Weight | 339.13 g/mol |
| LogP | 2.5529 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.13315 |
| Heavy Atoms | 25 |
| Complexity | 920.6829 |
Chemical Identifiers
| CAS Number | 636581-12-9 |
|---|---|
| SMILES | CCNC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CN=CC=C3)C(=O)OC |
Product Overview
Benzimidazole urea analogue, 10 (CAS 636581-12-9), with molecular formula C17H17N5O3 and molecular weight 339.13 g/mol. IUPAC: methyl 2-(ethylcarbamoylamino)-6-pyridin-3-yl-1H-benzimidazole-4-carboxylate.
Chemical Property Profile of Benzimidazole urea analogue, 10
Property Insights of Benzimidazole urea analogue, 10
The XLogP value of 2.5529 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzimidazole urea analogue, 10. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzimidazole urea analogue, 10. Following Lipinski's Rule of Five, Benzimidazole urea analogue, 10 has 3 hydrogen bond donor(s) and 5 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 Benzimidazole urea analogue, 10?
The CAS number of Benzimidazole urea analogue, 10 is 636581-12-9.
What is the molecular formula of Benzimidazole urea analogue, 10?
The molecular formula of Benzimidazole urea analogue, 10 is C17H17N5O3.
What is the molecular weight of Benzimidazole urea analogue, 10?
The molecular weight of Benzimidazole urea analogue, 10 is 339.13 g/mol.
Where can I buy Benzimidazole urea analogue, 10?
You can request a quote for Benzimidazole urea analogue, 10 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzimidazole urea analogue, 10?
Yes, KEHONG BIO provides custom synthesis services for Benzimidazole urea analogue, 10 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.