Org 3770 glucuronide
TL;DR: Org 3770 glucuronide (CAS 14746-98-6) is a chemical compound with molecular formula C23H25N3O8 and molecular weight 471.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(7S)-2,5,19-triazatetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),8,10,12,16,18-hexaene-5-carbonyl]oxyoxane-2-carboxylic acid
Also Known As: Org 3770 glucuronide, Org-3770-glucuronide, (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(7S)-2,5,19-triazatetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),8,10,12,16,18-hexaene-5-carbonyl]oxyoxane-2-carboxylic acid, 1-o-[(14bs)-3,4,10,14b-tetrahydropyrazino[2,1-a]pyrido[2,3-c][2]benzazepin-2(1h)-ylcarbonyl]-, A-d-glucopyranuronic acid
| Molecular Formula | C23H25N3O8 |
|---|---|
| Molecular Weight | 471.16 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 153.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 471.16415 |
| Heavy Atoms | 34 |
| Complexity | 770.0 |
Chemical Identifiers
| CAS Number | 14746-98-6 |
|---|---|
| SMILES | C1CN2[C@H](CN1C(=O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)C4=CC=CC=C4CC5=C2N=CC=C5 |
| InChIKey | GFGVDJCMKUMBBF-OIFKZHMHSA-N |
Product Overview
Org 3770 glucuronide (CAS 14746-98-6), with molecular formula C23H25N3O8 and molecular weight 471.16 g/mol. IUPAC: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(7S)-2,5,19-triazatetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),8,10,12,16,18-hexaene-5-carbonyl]oxyoxane-2-carboxylic acid.
Chemical Property Profile of Org 3770 glucuronide
Property Insights of Org 3770 glucuronide
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Org 3770 glucuronide. The TPSA of 153.0 Ų indicates high polarity, suggesting Org 3770 glucuronide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Org 3770 glucuronide has 4 hydrogen bond donor(s) and 10 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 Org 3770 glucuronide?
The CAS number of Org 3770 glucuronide is 14746-98-6.
What is the molecular formula of Org 3770 glucuronide?
The molecular formula of Org 3770 glucuronide is C23H25N3O8.
What is the molecular weight of Org 3770 glucuronide?
The molecular weight of Org 3770 glucuronide is 471.16 g/mol.
Where can I buy Org 3770 glucuronide?
You can request a quote for Org 3770 glucuronide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Org 3770 glucuronide?
Yes, KEHONG BIO provides custom synthesis services for Org 3770 glucuronide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.