5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one
TL;DR: 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one (CAS 19231-16-4) is a chemical compound with molecular formula C33H24ClNO9 and molecular weight 613.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,5-dibenzoyloxy-6-(5-chloro-2-oxo-1,3-benzoxazol-3-yl)oxan-3-yl] benzoate
Also Known As: 5-chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one, [4,5-dibenzoyloxy-6-(5-chloro-2-oxo-1,3-benzoxazol-3-yl)oxan-3-yl] benzoate
| Molecular Formula | C33H24ClNO9 |
|---|---|
| Molecular Weight | 613.11 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 613.11395 |
| Heavy Atoms | 44 |
| Complexity | 1040.0 |
Chemical Identifiers
| CAS Number | 19231-16-4 |
|---|---|
| SMILES | C1C(C(C(C(O1)N2C3=C(C=CC(=C3)Cl)OC2=O)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6 |
| InChIKey | PUIKTJWNEDIGKC-UHFFFAOYSA-N |
Product Overview
5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one (CAS 19231-16-4), with molecular formula C33H24ClNO9 and molecular weight 613.11 g/mol. IUPAC: [4,5-dibenzoyloxy-6-(5-chloro-2-oxo-1,3-benzoxazol-3-yl)oxan-3-yl] benzoate.
Chemical Property Profile of 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one
Property Insights of 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one
The XLogP value of 6.6 indicates that 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one. Following Lipinski's Rule of Five, 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one?
The CAS number of 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one is 19231-16-4.
What is the molecular formula of 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one?
The molecular formula of 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one is C33H24ClNO9.
What is the molecular weight of 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one?
The molecular weight of 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one is 613.11 g/mol.
Where can I buy 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one?
You can request a quote for 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-3-(2,3,4-tri-o-benzoylpentopyranosyl)-1,3-benzoxazol-2(3h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.