4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli
TL;DR: 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli (CAS 29822-10-4) is a chemical compound with molecular formula C16H16N8O4S and molecular weight 416.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)diazenyl]-N-pyrimidin-2-ylbenzenesulfonamide
Also Known As: 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli, 4-[(2Z)-2-(4-Imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-ylidene)hydrazin-1-yl]-N-(pyrimidin-2-yl)benzene-1-sulfonamide, 4-[(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)diazenyl]-N-pyrimidin-2-ylbenzenesulfonamide, 4-[2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-ylidene)hydrazinyl]-N-pyrimidin-2-ylbenzenesulfonamide, BENZENESULFONAMIDE,4-[2-(6-AMINO-1,2,3,4-TETRAHYDRO-1,3-DIMETHYL-2,4-DIOXO-5-PYRIMIDINYL)DIAZENYL]-N-2-PYRIMIDINYL-
| Molecular Formula | C16H16N8O4S |
|---|---|
| Molecular Weight | 416.10 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 172.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 416.10153 |
| Heavy Atoms | 29 |
| Complexity | 807.0 |
Chemical Identifiers
| CAS Number | 29822-10-4 |
|---|---|
| SMILES | CN1C(=C(C(=O)N(C1=O)C)N=NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)N |
| InChIKey | MNNMLRBRVKFNGX-UHFFFAOYSA-N |
Product Overview
4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli (CAS 29822-10-4), with molecular formula C16H16N8O4S and molecular weight 416.10 g/mol. IUPAC: 4-[(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)diazenyl]-N-pyrimidin-2-ylbenzenesulfonamide.
Chemical Property Profile of 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli
Property Insights of 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli. The TPSA of 172.0 Ų indicates high polarity, suggesting 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli has 2 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 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli?
The CAS number of 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli is 29822-10-4.
What is the molecular formula of 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli?
The molecular formula of 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli is C16H16N8O4S.
What is the molecular weight of 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli?
The molecular weight of 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli is 416.10 g/mol.
Where can I buy 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli?
You can request a quote for 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2E)-2-(4-imino-1,3-dimethyl-2,6-dioxo-1,3-diazinan-5-yli and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.