2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl-
TL;DR: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl- (CAS 70863-01-3) is a chemical compound with molecular formula C18H17N7O4S and molecular weight 427.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene)amino]acetamide
Also Known As: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl-, 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene)amino]acetamide
| Molecular Formula | C18H17N7O4S |
|---|---|
| Molecular Weight | 427.11 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 427.10626 |
| Heavy Atoms | 30 |
| Complexity | 784.0 |
Chemical Identifiers
| CAS Number | 70863-01-3 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NN=C3N(C(=O)CS3)C4=CC=CC=C4 |
| InChIKey | KKMOADXZITYWEC-UHFFFAOYSA-N |
Product Overview
2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl- (CAS 70863-01-3), with molecular formula C18H17N7O4S and molecular weight 427.11 g/mol. IUPAC: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene)amino]acetamide.
Chemical Property Profile of 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl-
Property Insights of 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl-. The TPSA of 146.0 Ų indicates high polarity, suggesting 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl- has 1 hydrogen bond donor(s) and 7 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 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl-?
The CAS number of 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl- is 70863-01-3.
What is the molecular formula of 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl-?
The molecular formula of 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl- is C18H17N7O4S.
What is the molecular weight of 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl-?
The molecular weight of 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl- is 427.11 g/mol.
Where can I buy 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl-?
You can request a quote for 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(Z)-(4-oxo-3-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.