Dobutamine Hydrochloride
TL;DR: Dobutamine Hydrochloride (CAS 49745-95-1) is a chemical compound with molecular formula C18H24ClNO3 and molecular weight 337.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[4-(4-hydroxyphenyl)butan-2-ylamino]ethyl]benzene-1,2-diol;hydrochloride
Also Known As: Dobutamine hydrochloride, Dobutamine Hcl, Dobutrex, Inotrex, dobutamine
| Molecular Formula | C18H24ClNO3 |
|---|---|
| Molecular Weight | 337.14 g/mol |
| LogP | 3.38 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 337.14447 |
| Heavy Atoms | 23 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 49745-95-1 |
|---|---|
| SMILES | CC(CCC1=CC=C(C=C1)O)NCCC2=CC(=C(C=C2)O)O.Cl |
| InChIKey | BQKADKWNRWCIJL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dobutamine Hydrochloride (CAS 49745-95-1), with molecular formula C18H24ClNO3 and molecular weight 337.14 g/mol. IUPAC: 4-[2-[4-(4-hydroxyphenyl)butan-2-ylamino]ethyl]benzene-1,2-diol;hydrochloride.
Chemical Property Profile of Dobutamine Hydrochloride
Property Insights of Dobutamine Hydrochloride
The XLogP value of 3.38 indicates that Dobutamine Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Dobutamine Hydrochloride. Following Lipinski's Rule of Five, Dobutamine Hydrochloride has 5 hydrogen bond donor(s) and 4 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 Dobutamine Hydrochloride?
The CAS number of Dobutamine Hydrochloride is 49745-95-1.
What is the molecular formula of Dobutamine Hydrochloride?
The molecular formula of Dobutamine Hydrochloride is C18H24ClNO3.
What is the molecular weight of Dobutamine Hydrochloride?
The molecular weight of Dobutamine Hydrochloride is 337.14 g/mol.
Where can I buy Dobutamine Hydrochloride?
You can request a quote for Dobutamine Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dobutamine Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Dobutamine Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.