AB01284629-01
TL;DR: AB01284629-01 (CAS 845803-61-4) is a chemical compound with molecular formula C27H22N4O4 and molecular weight 466.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(4-methoxyphenyl)-13-[(4-methoxyphenyl)methyl]-2-oxa-12,14,15,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),4,6,11,13,16-heptaen-5-ol
Also Known As: AB01284629-01, 2-(4-methoxybenzyl)-12-(4-methoxyphenyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol, 2-(4-methoxybenzyl)-12-(4-methoxyphenyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3-ium-9-olate
| Molecular Formula | C27H22N4O4 |
|---|---|
| Molecular Weight | 466.16 g/mol |
| LogP | 4.7238 |
| Topological Polar Surface Area | 91.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 466.1641 |
| Heavy Atoms | 35 |
| Complexity | 1528.1724 |
Chemical Identifiers
| CAS Number | 845803-61-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CC2=NN3C=NC4=C(C3=N2)C(C5=C(O4)C=C(C=C5)O)C6=CC=C(C=C6)OC |
Product Overview
AB01284629-01 (CAS 845803-61-4), with molecular formula C27H22N4O4 and molecular weight 466.16 g/mol. IUPAC: 9-(4-methoxyphenyl)-13-[(4-methoxyphenyl)methyl]-2-oxa-12,14,15,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),4,6,11,13,16-heptaen-5-ol.
Chemical Property Profile of AB01284629-01
Property Insights of AB01284629-01
The XLogP value of 4.7238 indicates that AB01284629-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01284629-01. Following Lipinski's Rule of Five, AB01284629-01 has 1 hydrogen bond donor(s) and 7 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 AB01284629-01?
The CAS number of AB01284629-01 is 845803-61-4.
What is the molecular formula of AB01284629-01?
The molecular formula of AB01284629-01 is C27H22N4O4.
What is the molecular weight of AB01284629-01?
The molecular weight of AB01284629-01 is 466.16 g/mol.
Where can I buy AB01284629-01?
You can request a quote for AB01284629-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01284629-01?
Yes, KEHONG BIO provides custom synthesis services for AB01284629-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.