NCIOpen2_009971
TL;DR: NCIOpen2_009971 (CAS 92352-38-0) is a chemical compound with molecular formula C8H12N8O2 and molecular weight 252.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[2-(diaminomethylidene)hydrazinyl]-2,5-dihydroxyphenyl]iminoguanidine
Also Known As: NCIOpen2_009971, (2E,2'E)-2,2'-(2,5-Dihydroxycyclohexa-2,5-diene-1,4-diylidene)dihydrazinecarboximidamide, 2-[[4-[2-(diaminomethylidene)hydrazinyl]-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]guanidine, 1-[(E)-[(4E)-4-(carbamimidoylhydrazono)-2,5-dihydroxy-cyclohexa-2,5-dien-1-ylidene]amino]guanidine
| Molecular Formula | C8H12N8O2 |
|---|---|
| Molecular Weight | 252.11 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 191.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.10832 |
| Heavy Atoms | 18 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 92352-38-0 |
|---|---|
| SMILES | C1=C(C(=CC(=C1O)N=NC(=N)N)O)NN=C(N)N |
| InChIKey | CXMHOKVZNMMKKF-UHFFFAOYSA-N |
Product Overview
NCIOpen2_009971 (CAS 92352-38-0), with molecular formula C8H12N8O2 and molecular weight 252.11 g/mol. IUPAC: 1-[4-[2-(diaminomethylidene)hydrazinyl]-2,5-dihydroxyphenyl]iminoguanidine.
Chemical Property Profile of NCIOpen2_009971
Property Insights of NCIOpen2_009971
The XLogP value of -0.5 indicates that NCIOpen2_009971 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 191.0 Ų indicates high polarity, suggesting NCIOpen2_009971 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, NCIOpen2_009971 has 7 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of NCIOpen2_009971?
The CAS number of NCIOpen2_009971 is 92352-38-0.
What is the molecular formula of NCIOpen2_009971?
The molecular formula of NCIOpen2_009971 is C8H12N8O2.
What is the molecular weight of NCIOpen2_009971?
The molecular weight of NCIOpen2_009971 is 252.11 g/mol.
Where can I buy NCIOpen2_009971?
You can request a quote for NCIOpen2_009971 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCIOpen2_009971?
Yes, KEHONG BIO provides custom synthesis services for NCIOpen2_009971 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.