Antibacterial agent 27
TL;DR: Antibacterial agent 27 (CAS 65795-51-9) is a chemical compound with molecular formula C18H14N6 and molecular weight 314.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(1,3-diaminopyrrolo[3,2-f]quinazolin-7-yl)methyl]benzonitrile
Also Known As: Antibacterial agent 27, 4-[(1,3-diaminopyrrolo[3,2-f]quinazolin-7-yl)methyl]benzonitrile, 4-((1,3-Diamino-7H-pyrrolo[3,2-f]quinazolin-7-yl)methyl)benzonitrile, Benzonitrile, 4-[(1,3-diamino-7H-pyrrolo[3,2-f]quinazolin-7-yl)methyl]-
| Molecular Formula | C18H14N6 |
|---|---|
| Molecular Weight | 314.13 g/mol |
| LogP | 2.66888 |
| Topological Polar Surface Area | 106.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.128 |
| Heavy Atoms | 24 |
| Complexity | 1102.465 |
Chemical Identifiers
| CAS Number | 65795-51-9 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C=CC3=C2C=CC4=C3C(=NC(=N4)N)N)C#N |
Product Overview
Antibacterial agent 27 (CAS 65795-51-9), with molecular formula C18H14N6 and molecular weight 314.13 g/mol. IUPAC: 4-[(1,3-diaminopyrrolo[3,2-f]quinazolin-7-yl)methyl]benzonitrile.
Chemical Property Profile of Antibacterial agent 27
Property Insights of Antibacterial agent 27
The XLogP value of 2.66888 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Antibacterial agent 27. The TPSA of 106.54 Ų falls within the moderate polarity range, balancing permeability and solubility for Antibacterial agent 27. Following Lipinski's Rule of Five, Antibacterial agent 27 has 2 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 Antibacterial agent 27?
The CAS number of Antibacterial agent 27 is 65795-51-9.
What is the molecular formula of Antibacterial agent 27?
The molecular formula of Antibacterial agent 27 is C18H14N6.
What is the molecular weight of Antibacterial agent 27?
The molecular weight of Antibacterial agent 27 is 314.13 g/mol.
Where can I buy Antibacterial agent 27?
You can request a quote for Antibacterial agent 27 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Antibacterial agent 27?
Yes, KEHONG BIO provides custom synthesis services for Antibacterial agent 27 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.