AH 21-132
TL;DR: AH 21-132 (CAS 76166-55-7) is a chemical compound with molecular formula C31H35N3O11 and molecular weight 625.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(4aR,10bS)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1H-benzo[c][1,6]naphthyridin-6-yl]phenyl]acetamide;bis((E)-but-2-enedioic acid)
Also Known As: Benafentrine dimaleate, AH 21132, AH-21-132, AH 21-132, Benafentrine dimaleate < Rec INNM >
| Molecular Formula | C31H35N3O11 |
|---|---|
| Molecular Weight | 625.23 g/mol |
| LogP | 2.7245 |
| Topological Polar Surface Area | 212.36 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 625.2272 |
| Heavy Atoms | 45 |
| Complexity | 1430.8458 |
Chemical Identifiers
| CAS Number | 76166-55-7 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)C2=N[C@H]3[C@@H](C4=CC(=C(C=C24)OC)OC)CN(CC3)C.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
AH 21-132 (CAS 76166-55-7), with molecular formula C31H35N3O11 and molecular weight 625.23 g/mol. IUPAC: N-[4-[(4aR,10bS)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1H-benzo[c][1,6]naphthyridin-6-yl]phenyl]acetamide;bis((E)-but-2-enedioic acid).
Chemical Property Profile of AH 21-132
Property Insights of AH 21-132
The XLogP value of 2.7245 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AH 21-132. The TPSA of 212.36 Ų indicates high polarity, suggesting AH 21-132 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AH 21-132 has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AH 21-132?
The CAS number of AH 21-132 is 76166-55-7.
What is the molecular formula of AH 21-132?
The molecular formula of AH 21-132 is C31H35N3O11.
What is the molecular weight of AH 21-132?
The molecular weight of AH 21-132 is 625.23 g/mol.
Where can I buy AH 21-132?
You can request a quote for AH 21-132 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH 21-132?
Yes, KEHONG BIO provides custom synthesis services for AH 21-132 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.