![10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine structure](/static/products/3465/34658-49-6.webp)
10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine
TL;DR: 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine (CAS 34658-49-6) is a chemical compound with molecular formula C13H13ClN4 and molecular weight 260.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-chloro-4,6-diazatricyclo[9.4.0.02,7]pentadeca-1(11),2(7),3,5,12,14-hexaene-3,5-diamine
Also Known As: EX-A7943W, J1.265.713G, 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine, 5H-Benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine, 10-chloro-6,7-dihydro-, 10-chloro-6,7-dihydro-5H-benzo[[?]:[?]]cyclohepta[[?]]pyrimidine-1,3-diamine
| Molecular Formula | C13H13ClN4 |
|---|---|
| Molecular Weight | 260.08 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 260.0829 |
| Heavy Atoms | 18 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 34658-49-6 |
|---|---|
| SMILES | C1CC2=C(C=C(C=C2)Cl)C3=C(C1)N=C(N=C3N)N |
| InChIKey | IXLXFIHTMQZLIF-UHFFFAOYSA-N |
Product Overview
10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine (CAS 34658-49-6), with molecular formula C13H13ClN4 and molecular weight 260.08 g/mol. IUPAC: 14-chloro-4,6-diazatricyclo[9.4.0.02,7]pentadeca-1(11),2(7),3,5,12,14-hexaene-3,5-diamine.
Chemical Property Profile of 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine
Property Insights of 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine. Following Lipinski's Rule of Five, 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine has 2 hydrogen bond donor(s) and 4 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 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine?
The CAS number of 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine is 34658-49-6.
What is the molecular formula of 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine?
The molecular formula of 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine is C13H13ClN4.
What is the molecular weight of 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine?
The molecular weight of 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine is 260.08 g/mol.
Where can I buy 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine?
You can request a quote for 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine?
Yes, KEHONG BIO provides custom synthesis services for 10-Chloro-6,7-dihydro-5H-benzo[3,4]cyclohepta[1,2-d]pyrimidine-1,3-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.