AB00133306-02
TL;DR: AB00133306-02 (CAS 305332-74-5) is a chemical compound with molecular formula C27H22N4 and molecular weight 402.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-3-methyl-1-(4-methylanilino)pyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: AB00133306-02, 2-benzyl-3-methyl-1-(p-tolylamino)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 12-benzyl-11-methyl-13-[(4-methylphenyl)amino]-1,8-diazatricyclo[7.4.0.0^{2,7}]trideca-2(7),3,5,8,10,12-hexaene-10-carbonitrile, F1092-0147, 2-benzyl-3-methyl-1-[(4-methylphenyl)amino]pyrido[1,2-a]benzimidazole-4-carbonitrile
| Molecular Formula | C27H22N4 |
|---|---|
| Molecular Weight | 402.18 g/mol |
| LogP | 6.31042 |
| Topological Polar Surface Area | 53.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.18445 |
| Heavy Atoms | 31 |
| Complexity | 1438.9238 |
Chemical Identifiers
| CAS Number | 305332-74-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=C(C(=C(C3=NC4=CC=CC=C4N23)C#N)C)CC5=CC=CC=C5 |
Product Overview
AB00133306-02 (CAS 305332-74-5), with molecular formula C27H22N4 and molecular weight 402.18 g/mol. IUPAC: 2-benzyl-3-methyl-1-(4-methylanilino)pyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of AB00133306-02
Property Insights of AB00133306-02
The XLogP value of 6.31042 indicates that AB00133306-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.12 Ų, AB00133306-02 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00133306-02 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00133306-02?
The CAS number of AB00133306-02 is 305332-74-5.
What is the molecular formula of AB00133306-02?
The molecular formula of AB00133306-02 is C27H22N4.
What is the molecular weight of AB00133306-02?
The molecular weight of AB00133306-02 is 402.18 g/mol.
Where can I buy AB00133306-02?
You can request a quote for AB00133306-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00133306-02?
Yes, KEHONG BIO provides custom synthesis services for AB00133306-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.