1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one
TL;DR: 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one (CAS 56047-12-2) is a chemical compound with molecular formula C7H8N4O and molecular weight 164.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-diamino-1,3-dihydrobenzimidazol-2-one
Also Known As: 5,6-Diamino-1,3-dihydro-2H-benzoimidazol-2-one, 5,6-Diaminobenzimidazolinone, 5,6-Diaminobenzimidazolone, 5,6-DIAMINO-2-HYDROXYBENZIMIDAZOLE, 5,6-diamino-1,3-dihydrobenzimidazol-2-one
| Molecular Formula | C7H8N4O |
|---|---|
| Molecular Weight | 164.07 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 93.2 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.06981 |
| Heavy Atoms | 12 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 56047-12-2 |
|---|---|
| SMILES | C1=C(C(=CC2=C1NC(=O)N2)N)N |
| InChIKey | BRISYWKBJNSDPL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one (CAS 56047-12-2), with molecular formula C7H8N4O and molecular weight 164.07 g/mol. IUPAC: 5,6-diamino-1,3-dihydrobenzimidazol-2-one.
Chemical Property Profile of 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one
Property Insights of 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one
The XLogP value of -0.8 indicates that 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one. Following Lipinski's Rule of Five, 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one has 4 hydrogen bond donor(s) and 3 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 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one?
The CAS number of 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one is 56047-12-2.
What is the molecular formula of 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one?
The molecular formula of 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one is C7H8N4O.
What is the molecular weight of 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one?
The molecular weight of 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one is 164.07 g/mol.
Where can I buy 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one?
You can request a quote for 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1,3-dihydro-5,6-diamino-2H-benzimidazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.