Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone
TL;DR: Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone (CAS 140458-70-4) is a chemical compound with molecular formula C28H30N4O7 and molecular weight 534.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-amino-2-[3-(dimethylamino)-1,5-dimethyl-6-oxo-4-(2,3,4-trimethoxyphenyl)-2-pyridinyl]-6-methoxyquinoline-5,8-dione
Also Known As: Tetrame-streptonigrone, Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone, N(1'),N(5'),N(5'),O(8')-Tetramethylstreptonigrone, Tri-1/',5/',5/'-N,N,N-mono-8/'-O-methylstreptonigrone, 7-amino-2-[3-(dimethylamino)-1,5-dimethyl-6-oxo-4-(2,3,4-trimethoxyphenyl)-1,6-dihydropyridin-2-yl]-6-methoxyquinoline-5,8-dione
| Molecular Formula | C28H30N4O7 |
|---|---|
| Molecular Weight | 534.21 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 534.2114 |
| Heavy Atoms | 39 |
| Complexity | 1130.0 |
Chemical Identifiers
| CAS Number | 140458-70-4 |
|---|---|
| SMILES | CC1=C(C(=C(N(C1=O)C)C2=NC3=C(C=C2)C(=O)C(=C(C3=O)N)OC)N(C)C)C4=C(C(=C(C=C4)OC)OC)OC |
| InChIKey | YYGDZXGKAQGKHH-UHFFFAOYSA-N |
Product Overview
Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone (CAS 140458-70-4), with molecular formula C28H30N4O7 and molecular weight 534.21 g/mol. IUPAC: 7-amino-2-[3-(dimethylamino)-1,5-dimethyl-6-oxo-4-(2,3,4-trimethoxyphenyl)-2-pyridinyl]-6-methoxyquinoline-5,8-dione.
Chemical Property Profile of Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone
Property Insights of Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone. Following Lipinski's Rule of Five, Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone?
The CAS number of Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone is 140458-70-4.
What is the molecular formula of Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone?
The molecular formula of Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone is C28H30N4O7.
What is the molecular weight of Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone?
The molecular weight of Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone is 534.21 g/mol.
Where can I buy Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone?
You can request a quote for Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone?
Yes, KEHONG BIO provides custom synthesis services for Tri-1',5',5'-N,N,N-mono-8'-O-methylstreptonigrone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.