(C22-H25-N-O3.C3-H5-N-O.Cl-H)mult-
TL;DR: (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult- (CAS 65452-11-1) is a chemical compound with molecular formula C25H31ClN2O4 and molecular weight 458.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,9R,13R)-10-(furan-3-ylmethyl)-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-yl] prop-2-enoate;prop-2-enamide;hydrochloride
Also Known As: (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult-, 2-Propenoic acid, 3-(3-furanylmethyl)-1,2,3,4,5,6-hexahydro-6,11-dimethyl-2,6-methano-3-benzazocin-8-yl ester, hydrochloride (2R-(2-alpha,6-alpha,11R*))-, polymer with 2-propenanamide
| Molecular Formula | C25H31ClN2O4 |
|---|---|
| Molecular Weight | 458.20 g/mol |
| LogP | 4.1749 |
| Topological Polar Surface Area | 85.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 458.19724 |
| Heavy Atoms | 32 |
| Complexity | 972.3265 |
Chemical Identifiers
| CAS Number | 65452-11-1 |
|---|---|
| SMILES | C[C@H]1[C@H]2CC3=C([C@@]1(CCN2CC4=COC=C4)C)C=C(C=C3)OC(=O)C=C.C=CC(=O)N.Cl |
Product Overview
(C22-H25-N-O3.C3-H5-N-O.Cl-H)mult- (CAS 65452-11-1), with molecular formula C25H31ClN2O4 and molecular weight 458.20 g/mol. IUPAC: [(1R,9R,13R)-10-(furan-3-ylmethyl)-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-yl] prop-2-enoate;prop-2-enamide;hydrochloride.
Chemical Property Profile of (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult-
Property Insights of (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult-
The XLogP value of 4.1749 indicates that (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.77 Ų falls within the moderate polarity range, balancing permeability and solubility for (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult-. Following Lipinski's Rule of Five, (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult- has 1 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 (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult-?
The CAS number of (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult- is 65452-11-1.
What is the molecular formula of (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult-?
The molecular formula of (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult- is C25H31ClN2O4.
What is the molecular weight of (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult-?
The molecular weight of (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult- is 458.20 g/mol.
Where can I buy (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult-?
You can request a quote for (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult-?
Yes, KEHONG BIO provides custom synthesis services for (C22-H25-N-O3.C3-H5-N-O.Cl-H)mult- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.