3'-Gal-1-4-gal-ara-C
TL;DR: 3'-Gal-1-4-gal-ara-C (CAS 155603-73-9) is a chemical compound with molecular formula C21H33N3O15 and molecular weight 567.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-1-[(2R,3S,4R,5R)-5-(hydroxymethyl)-3,4-bis[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxolan-2-yl]pyrimidin-2-one
Also Known As: 3'-Gal-1-4-gal-ara-C, 3'-O-Galactopyranosyl-1-4-O-galactopyranosylcytarabine, 4-amino-1-[(2R,3S,4R,5R)-5-(hydroxymethyl)-3,4-bis[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxolan-2-yl]pyrimidin-2-one, 4-Amino-1-[(2R,3S,4R,5R)-5-(hydroxymethyl)-3,4-bis{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]pyrimidin-2(1H)-one
| Molecular Formula | C21H33N3O15 |
|---|---|
| Molecular Weight | 567.19 g/mol |
| LogP | -5.9 |
| Topological Polar Surface Area | 287.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 8 |
| Exact Mass | 567.19116 |
| Heavy Atoms | 39 |
| Complexity | 925.0 |
Chemical Identifiers
| CAS Number | 155603-73-9 |
|---|---|
| SMILES | C1=CN(C(=O)N=C1N)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O |
| InChIKey | ORAXAMWDQSXBKN-DVBHINJSSA-N |
Product Overview
3'-Gal-1-4-gal-ara-C (CAS 155603-73-9), with molecular formula C21H33N3O15 and molecular weight 567.19 g/mol. IUPAC: 4-amino-1-[(2R,3S,4R,5R)-5-(hydroxymethyl)-3,4-bis[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxolan-2-yl]pyrimidin-2-one.
Chemical Property Profile of 3'-Gal-1-4-gal-ara-C
Property Insights of 3'-Gal-1-4-gal-ara-C
The XLogP value of -5.9 indicates that 3'-Gal-1-4-gal-ara-C is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 287.0 Ų indicates high polarity, suggesting 3'-Gal-1-4-gal-ara-C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3'-Gal-1-4-gal-ara-C has 10 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3'-Gal-1-4-gal-ara-C?
The CAS number of 3'-Gal-1-4-gal-ara-C is 155603-73-9.
What is the molecular formula of 3'-Gal-1-4-gal-ara-C?
The molecular formula of 3'-Gal-1-4-gal-ara-C is C21H33N3O15.
What is the molecular weight of 3'-Gal-1-4-gal-ara-C?
The molecular weight of 3'-Gal-1-4-gal-ara-C is 567.19 g/mol.
Where can I buy 3'-Gal-1-4-gal-ara-C?
You can request a quote for 3'-Gal-1-4-gal-ara-C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Gal-1-4-gal-ara-C?
Yes, KEHONG BIO provides custom synthesis services for 3'-Gal-1-4-gal-ara-C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.