RefChem:377707
TL;DR: RefChem:377707 (CAS 79513-56-7) is a chemical compound with molecular formula C15H21N3O4S and molecular weight 339.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methanesulfonic acid;8-methoxy-1-prop-2-enyl-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole
Also Known As: 1-Allyl-8-methoxy-1,2,3,4-tetrahydropyrimido(1,2-a)benzimidazole methanesulfonate, Pyrimido(1,2-a)benzimidazole, 1,2,3,4-tetrahydro-1-allyl-8-methoxy-, methanesulfonate, methanesulfonic acid; 8-methoxy-1-prop-2-enyl-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole, Methanesulfonic acid--8-methoxy-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimido[1,2-a][1,3]benzimidazole (1/1), RefChem:377707
| Molecular Formula | C15H21N3O4S |
|---|---|
| Molecular Weight | 339.13 g/mol |
| LogP | 1.945 |
| Topological Polar Surface Area | 84.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.12527 |
| Heavy Atoms | 23 |
| Complexity | 790.4 |
Chemical Identifiers
| CAS Number | 79513-56-7 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)N3CCCN(C3=N2)CC=C.CS(=O)(=O)O |
Product Overview
RefChem:377707 (CAS 79513-56-7), with molecular formula C15H21N3O4S and molecular weight 339.13 g/mol. IUPAC: methanesulfonic acid;8-methoxy-1-prop-2-enyl-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole.
Chemical Property Profile of RefChem:377707
Property Insights of RefChem:377707
The XLogP value of 1.945 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:377707. The TPSA of 84.66 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:377707. Following Lipinski's Rule of Five, RefChem:377707 has 1 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 RefChem:377707?
The CAS number of RefChem:377707 is 79513-56-7.
What is the molecular formula of RefChem:377707?
The molecular formula of RefChem:377707 is C15H21N3O4S.
What is the molecular weight of RefChem:377707?
The molecular weight of RefChem:377707 is 339.13 g/mol.
Where can I buy RefChem:377707?
You can request a quote for RefChem:377707 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:377707?
Yes, KEHONG BIO provides custom synthesis services for RefChem:377707 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.