AB01312362-01
TL;DR: AB01312362-01 (CAS 606945-65-7) is a chemical compound with molecular formula C17H13BrN4O2 and molecular weight 384.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-bromophenoxy)methyl]-5-(pyridin-3-ylmethylamino)-1,3-oxazole-4-carbonitrile
Also Known As: AB01312362-01, 2-[(4-bromophenoxy)methyl]-5-[(pyridin-3-ylmethyl)amino]-1,3-oxazole-4-carbonitrile, 2-((4-bromophenoxy)methyl)-5-((pyridin-3-ylmethyl)amino)oxazole-4-carbonitrile, 2-[(4-bromophenoxy)methyl]-5-(pyridin-3-ylmethylamino)-1,3-oxazole-4-carbonitrile
| Molecular Formula | C17H13BrN4O2 |
|---|---|
| Molecular Weight | 384.02 g/mol |
| LogP | 3.89488 |
| Topological Polar Surface Area | 83.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 384.0222 |
| Heavy Atoms | 24 |
| Complexity | 841.27716 |
Chemical Identifiers
| CAS Number | 606945-65-7 |
|---|---|
| SMILES | C1=CC(=CN=C1)CNC2=C(N=C(O2)COC3=CC=C(C=C3)Br)C#N |
Product Overview
AB01312362-01 (CAS 606945-65-7), with molecular formula C17H13BrN4O2 and molecular weight 384.02 g/mol. IUPAC: 2-[(4-bromophenoxy)methyl]-5-(pyridin-3-ylmethylamino)-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of AB01312362-01
Property Insights of AB01312362-01
The XLogP value of 3.89488 indicates that AB01312362-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.97 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01312362-01. Following Lipinski's Rule of Five, AB01312362-01 has 1 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 AB01312362-01?
The CAS number of AB01312362-01 is 606945-65-7.
What is the molecular formula of AB01312362-01?
The molecular formula of AB01312362-01 is C17H13BrN4O2.
What is the molecular weight of AB01312362-01?
The molecular weight of AB01312362-01 is 384.02 g/mol.
Where can I buy AB01312362-01?
You can request a quote for AB01312362-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01312362-01?
Yes, KEHONG BIO provides custom synthesis services for AB01312362-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.