1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide
TL;DR: 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide (CAS 58483-85-5) is a chemical compound with molecular formula C10H14N4 and molecular weight 190.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboximidamide
Also Known As: 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide, 1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboximidamide, 1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboxamidine
| Molecular Formula | C10H14N4 |
|---|---|
| Molecular Weight | 190.12 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.12184 |
| Heavy Atoms | 14 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 58483-85-5 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C2N1)C(=N)N |
| InChIKey | UHBRXVWSEOVVBM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide (CAS 58483-85-5), with molecular formula C10H14N4 and molecular weight 190.12 g/mol. IUPAC: 1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboximidamide.
Chemical Property Profile of 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide
Property Insights of 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide. Following Lipinski's Rule of Five, 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide has 3 hydrogen bond donor(s) and 2 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 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide?
The CAS number of 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide is 58483-85-5.
What is the molecular formula of 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide?
The molecular formula of 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide is C10H14N4.
What is the molecular weight of 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide?
The molecular weight of 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide is 190.12 g/mol.
Where can I buy 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide?
You can request a quote for 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carboximidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.