Streptonigrin analog
TL;DR: Streptonigrin analog (CAS 99520-44-2) is a chemical compound with molecular formula C30H34N6O7 and molecular weight 590.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-6-(7-amino-6-methoxy-5,8-dioxoquinolin-2-yl)-N-[3-(dimethylamino)propyl]-4-(2-hydroxy-3,4-dimethoxyphenyl)-3-methylpyridine-2-carboxamide
Also Known As: Streptonigrin analog, STN-NHCH2CH2CH2N(CH3)2, 2-Pyridinecarboxamide, 5-amino-6-(7-amino-5,8-dihydro-6-methoxy-5,8-dioxo-2-quinolinyl)-N-(3-(dimethylamino)propyl)-4-(2-hydroxy-3,4-dimethoxyphenyl)-3-methyl-, (4Z)-5-amino-6-(7-amino-6-methoxy-5,8-dioxoquinolin-2-yl)-4-(4,5-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)-N-[3-(dimethylamino)propyl]-3-methyl-1H-pyridine-2-carboxamide, 2-Pyridinecarboxamide, 5-amino-6-(7-amino-5,8-dihydro-6-methoxy-5,8-dioxo-2-quinolinyl)-N-[3-(dimethylamino)propyl]-4-(2-hydroxy-3,4-dimethoxyphenyl)-3-methyl-
| Molecular Formula | C30H34N6O7 |
|---|---|
| Molecular Weight | 590.25 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 192.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Exact Mass | 590.2489 |
| Heavy Atoms | 43 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 99520-44-2 |
|---|---|
| SMILES | CC1=C(C(=C(N=C1C(=O)NCCCN(C)C)C2=NC3=C(C=C2)C(=O)C(=C(C3=O)N)OC)N)C4=C(C(=C(C=C4)OC)OC)O |
| InChIKey | RUKMSEXPFSJNJA-UHFFFAOYSA-N |
Product Overview
Streptonigrin analog (CAS 99520-44-2), with molecular formula C30H34N6O7 and molecular weight 590.25 g/mol. IUPAC: 5-amino-6-(7-amino-6-methoxy-5,8-dioxoquinolin-2-yl)-N-[3-(dimethylamino)propyl]-4-(2-hydroxy-3,4-dimethoxyphenyl)-3-methylpyridine-2-carboxamide.
Chemical Property Profile of Streptonigrin analog
Property Insights of Streptonigrin analog
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Streptonigrin analog. The TPSA of 192.0 Ų indicates high polarity, suggesting Streptonigrin analog may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Streptonigrin analog has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Streptonigrin analog?
The CAS number of Streptonigrin analog is 99520-44-2.
What is the molecular formula of Streptonigrin analog?
The molecular formula of Streptonigrin analog is C30H34N6O7.
What is the molecular weight of Streptonigrin analog?
The molecular weight of Streptonigrin analog is 590.25 g/mol.
Where can I buy Streptonigrin analog?
You can request a quote for Streptonigrin analog directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Streptonigrin analog?
Yes, KEHONG BIO provides custom synthesis services for Streptonigrin analog and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.