RefChem:1073750
TL;DR: RefChem:1073750 (CAS 63834-49-1) is a chemical compound with molecular formula C29H35ClN2O3 and molecular weight 494.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-morpholin-4-ium-4-yl-4,4-diphenylhexan-3-yl) 4-aminobenzoate chloride
Also Known As: 3-p-Aminobenzoxy-4,4-diphenyl-6-morpholinohexane hydrochloride, HEXANE, 3-p-AMINOBENZOXY-4,4-DIPHENYL-6-MORPHOLINO-, HYDROCHLORIDE, (6-morpholin-4-ium-4-yl-4,4-diphenylhexan-3-yl) 4-aminobenzoate chloride, 6-(Morpholin-4-yl)-4,4-diphenylhexan-3-yl 4-aminobenzoate--hydrogen chloride (1/1), 4-Morpholinebutanol, .alpha.-ethyl-.beta.,.beta.-diphenyl-, 4-aminobenzoate (ester), monohydrochloride
| Molecular Formula | C29H35ClN2O3 |
|---|---|
| Molecular Weight | 494.23 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 494.2336 |
| Heavy Atoms | 35 |
| Complexity | 582.0 |
Chemical Identifiers
| CAS Number | 63834-49-1 |
|---|---|
| SMILES | CCC(C(CC[NH+]1CCOCC1)(C2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)N.[Cl-] |
| InChIKey | QBISHGLLUNDCHP-UHFFFAOYSA-N |
Product Overview
RefChem:1073750 (CAS 63834-49-1), with molecular formula C29H35ClN2O3 and molecular weight 494.23 g/mol. IUPAC: (6-morpholin-4-ium-4-yl-4,4-diphenylhexan-3-yl) 4-aminobenzoate chloride.
Chemical Property Profile of RefChem:1073750
Property Insights of RefChem:1073750
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1073750. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1073750. Following Lipinski's Rule of Five, RefChem:1073750 has 2 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 RefChem:1073750?
The CAS number of RefChem:1073750 is 63834-49-1.
What is the molecular formula of RefChem:1073750?
The molecular formula of RefChem:1073750 is C29H35ClN2O3.
What is the molecular weight of RefChem:1073750?
The molecular weight of RefChem:1073750 is 494.23 g/mol.
Where can I buy RefChem:1073750?
You can request a quote for RefChem:1073750 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1073750?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1073750 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.