![6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine structure](/static/products/7243/72438-03-0.webp)
6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine
TL;DR: 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine (CAS 72438-03-0) is a chemical compound with molecular formula C16H16FN5 and molecular weight 297.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine
Also Known As: 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine, 6-{[(4-Fluorophenyl)(methyl)amino]methyl}quinazoline-2,4-diamine
| Molecular Formula | C16H16FN5 |
|---|---|
| Molecular Weight | 297.14 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 81.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.13898 |
| Heavy Atoms | 22 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 72438-03-0 |
|---|---|
| SMILES | CN(CC1=CC2=C(C=C1)N=C(N=C2N)N)C3=CC=C(C=C3)F |
| InChIKey | OOGHCCZPGJJGCI-UHFFFAOYSA-N |
Product Overview
6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine (CAS 72438-03-0), with molecular formula C16H16FN5 and molecular weight 297.14 g/mol. IUPAC: 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine.
Chemical Property Profile of 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine
Property Insights of 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine. The TPSA of 81.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine. Following Lipinski's Rule of Five, 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine has 2 hydrogen bond donor(s) and 6 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 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine?
The CAS number of 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine is 72438-03-0.
What is the molecular formula of 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine?
The molecular formula of 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine is C16H16FN5.
What is the molecular weight of 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine?
The molecular weight of 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine is 297.14 g/mol.
Where can I buy 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine?
You can request a quote for 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-[(4-fluoro-N-methylanilino)methyl]quinazoline-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.