Dimotapp
TL;DR: Dimotapp (CAS 87453-66-5) is a chemical compound with molecular formula C38H51Cl3N4O7 and molecular weight 780.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-amino-1-phenylpropan-1-ol;but-2-enedioic acid;3-(4-chlorophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine;3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol;dihydrochloride
Also Known As: Dimotapp, (2R)-2-amino-1-phenyl-propan-1-ol; but-2-enedioic acid; 3-(4-chlorophenyl)-N,N-dimethyl-3-pyridin-2-yl-propan-1-amine; 3-[(1R)-1-hydroxy-2-methylamino-ethyl]phenol; dihydrochloride
| Molecular Formula | C38H51Cl3N4O7 |
|---|---|
| Molecular Weight | 780.28 g/mol |
| LogP | 6.0862 |
| Topological Polar Surface Area | 189.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 12 |
| Exact Mass | 780.28235 |
| Heavy Atoms | 52 |
| Complexity | 608.0 |
Chemical Identifiers
| CAS Number | 87453-66-5 |
|---|---|
| SMILES | C[C@H](C(C1=CC=CC=C1)O)N.CNC[C@@H](C1=CC(=CC=C1)O)O.CN(C)CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2.C(=CC(=O)O)C(=O)O.Cl.Cl |
| InChIKey | HPLJKIRKESVBEY-CJGGCCGBSA-N |
Product Overview
Dimotapp (CAS 87453-66-5), with molecular formula C38H51Cl3N4O7 and molecular weight 780.28 g/mol. IUPAC: (2R)-2-amino-1-phenylpropan-1-ol;but-2-enedioic acid;3-(4-chlorophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine;3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol;dihydrochloride.
Chemical Property Profile of Dimotapp
Property Insights of Dimotapp
The XLogP value of 6.0862 indicates that Dimotapp is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 189.0 Ų indicates high polarity, suggesting Dimotapp may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dimotapp has 9 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dimotapp?
The CAS number of Dimotapp is 87453-66-5.
What is the molecular formula of Dimotapp?
The molecular formula of Dimotapp is C38H51Cl3N4O7.
What is the molecular weight of Dimotapp?
The molecular weight of Dimotapp is 780.28 g/mol.
Where can I buy Dimotapp?
You can request a quote for Dimotapp directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimotapp?
Yes, KEHONG BIO provides custom synthesis services for Dimotapp and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.