HEAT hydrochloride
TL;DR: HEAT hydrochloride (CAS 30007-39-7) is a chemical compound with molecular formula C19H22ClNO2 and molecular weight 331.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-hydroxyphenyl)ethyl-[(1-oxo-3,4-dihydro-2H-naphthalen-2-yl)methyl]azanium chloride
Also Known As: HEAT hydrochloride, HEAT, BE-2254 hydrochloride, 3,4-Dihydro-2-(((p-hydroxyphenethyl)amino)methyl)-1(2H)-naphthalenone hydrochloride, 2-(beta-(Hydroxyphenyl)ethylaminomethyl)tetralone hydrochloride
| Molecular Formula | C19H22ClNO2 |
|---|---|
| Molecular Weight | 331.13 g/mol |
| LogP | -1.05 |
| Topological Polar Surface Area | 53.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.1339 |
| Heavy Atoms | 23 |
| Complexity | 362.0 |
Chemical Identifiers
| CAS Number | 30007-39-7 |
|---|---|
| SMILES | C1CC2=CC=CC=C2C(=O)C1C[NH2+]CCC3=CC=C(C=C3)O.[Cl-] |
| InChIKey | VCZXZECZIRGUCZ-UHFFFAOYSA-N |
Product Overview
HEAT hydrochloride (CAS 30007-39-7), with molecular formula C19H22ClNO2 and molecular weight 331.13 g/mol. IUPAC: 2-(4-hydroxyphenyl)ethyl-[(1-oxo-3,4-dihydro-2H-naphthalen-2-yl)methyl]azanium chloride.
Chemical Property Profile of HEAT hydrochloride
Property Insights of HEAT hydrochloride
The XLogP value of -1.05 indicates that HEAT hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.9 Ų, HEAT hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, HEAT hydrochloride has 2 hydrogen bond donor(s) and 3 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 HEAT hydrochloride?
The CAS number of HEAT hydrochloride is 30007-39-7.
What is the molecular formula of HEAT hydrochloride?
The molecular formula of HEAT hydrochloride is C19H22ClNO2.
What is the molecular weight of HEAT hydrochloride?
The molecular weight of HEAT hydrochloride is 331.13 g/mol.
Where can I buy HEAT hydrochloride?
You can request a quote for HEAT hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for HEAT hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for HEAT hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.