![3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one structure](/static/products/1278/127800-66-2.webp)
3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one
TL;DR: 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one (CAS 127800-66-2) is a chemical compound with molecular formula C11H11N3O and molecular weight 201.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-one
Also Known As: 5-Bromo-2-(ethylthio)pyridine, NCI60_029883, J1.105.891D, 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one, 3,4-dihydro-3-methyl-pyrimidino[1,2-a]benzimidazol-2(1H)-one
| Molecular Formula | C11H11N3O |
|---|---|
| Molecular Weight | 201.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 46.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 201.09021 |
| Heavy Atoms | 15 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 127800-66-2 |
|---|---|
| SMILES | CC1CN2C3=CC=CC=C3N=C2NC1=O |
| InChIKey | WGEDKBYCFLUIEM-UHFFFAOYSA-N |
Product Overview
3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one (CAS 127800-66-2), with molecular formula C11H11N3O and molecular weight 201.09 g/mol. IUPAC: 3-methyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-one.
Chemical Property Profile of 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one
Property Insights of 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one. With a topological polar surface area (TPSA) of 46.9 Ų, 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one has 1 hydrogen bond donor(s) and 2 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 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one?
The CAS number of 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one is 127800-66-2.
What is the molecular formula of 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one?
The molecular formula of 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one is C11H11N3O.
What is the molecular weight of 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one?
The molecular weight of 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one is 201.09 g/mol.
Where can I buy 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one?
You can request a quote for 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dihydro-3-methyl-Pyrimido[1,2-a]benzimidazol-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.