1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1)
TL;DR: 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1) (CAS 38772-18-8) is a chemical compound with molecular formula C7H13ClN2O4 and molecular weight 224.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine;perchloric acid
Also Known As: 4,7-Dichloroindole, 2,3-Dihydro-5,7-dimethyl-1H-1,4-diazepine monoperchlorate, 5,7-Dimethyl-2,3-dihydro-1H-[1,4]diazepine perchlorate, 2,7-Dimethyl-3,6-diazacyclohepta-1,6-diene perchlorate, 5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine; perchloric acid
| Molecular Formula | C7H13ClN2O4 |
|---|---|
| Molecular Weight | 224.06 g/mol |
| LogP | -3.17 |
| Topological Polar Surface Area | 95.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 224.05638 |
| Heavy Atoms | 14 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 38772-18-8 |
|---|---|
| SMILES | CC1=CC(=NCCN1)C.OCl(=O)(=O)=O |
| InChIKey | LSBOWQYDCRFWCG-UHFFFAOYSA-N |
Product Overview
1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1) (CAS 38772-18-8), with molecular formula C7H13ClN2O4 and molecular weight 224.06 g/mol. IUPAC: 5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine;perchloric acid.
Chemical Property Profile of 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1)
Property Insights of 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1)
The XLogP value of -3.17 indicates that 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1). Following Lipinski's Rule of Five, 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1) has 2 hydrogen bond donor(s) and 6 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 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1)?
The CAS number of 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1) is 38772-18-8.
What is the molecular formula of 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1)?
The molecular formula of 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1) is C7H13ClN2O4.
What is the molecular weight of 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1)?
The molecular weight of 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1) is 224.06 g/mol.
Where can I buy 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1)?
You can request a quote for 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,4-Diazepine, 2,3-dihydro-5,7-dimethyl-, perchlorate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.