Ubg54Q2cvt
TL;DR: Ubg54Q2cvt (CAS 21830-16-0) is a chemical compound with molecular formula C13H21NO3 and molecular weight 239.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(1R,2S)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol
Also Known As: isoetharine, Isoetharine, (1R,2S)-, 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)butyl)-, (R-(R*,S*))-, Benzyl alcohol, 3,4-dihydroxy-alpha-(1-(isopropylamino)propyl)-, (-)-, 4-[(1R,2S)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol
| Molecular Formula | C13H21NO3 |
|---|---|
| Molecular Weight | 239.15 g/mol |
| LogP | 1.9078 |
| Topological Polar Surface Area | 72.72 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 239.15215 |
| Heavy Atoms | 17 |
| Complexity | 365.68225 |
Chemical Identifiers
| CAS Number | 21830-16-0 |
|---|---|
| SMILES | CC[C@@H]([C@@H](C1=CC(=C(C=C1)O)O)O)NC(C)C |
Product Overview
Ubg54Q2cvt (CAS 21830-16-0), with molecular formula C13H21NO3 and molecular weight 239.15 g/mol. IUPAC: 4-[(1R,2S)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol.
Chemical Property Profile of Ubg54Q2cvt
Property Insights of Ubg54Q2cvt
The XLogP value of 1.9078 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ubg54Q2cvt. The TPSA of 72.72 Ų falls within the moderate polarity range, balancing permeability and solubility for Ubg54Q2cvt. Following Lipinski's Rule of Five, Ubg54Q2cvt has 4 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 Ubg54Q2cvt?
The CAS number of Ubg54Q2cvt is 21830-16-0.
What is the molecular formula of Ubg54Q2cvt?
The molecular formula of Ubg54Q2cvt is C13H21NO3.
What is the molecular weight of Ubg54Q2cvt?
The molecular weight of Ubg54Q2cvt is 239.15 g/mol.
Where can I buy Ubg54Q2cvt?
You can request a quote for Ubg54Q2cvt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ubg54Q2cvt?
Yes, KEHONG BIO provides custom synthesis services for Ubg54Q2cvt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.