7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent
TL;DR: 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent (CAS 91757-88-9) is a chemical compound with molecular formula C15H16Cl2N6O and molecular weight 366.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10,12-dichloro-3-propoxy-7-pyrrolidin-1-yl-2,4,6,8,13-pentazatricyclo[7.3.1.05,13]trideca-1,3,5,7,9,11-hexaene
Also Known As: 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent, 7,9-Dichloro-2-propoxy-5-(pyrrolidin-1-yl)-1,3,4,6,9b-pentaazaphenalene, 10,12-Dichloro-3-propoxy-7-pyrrolidin-1-yl-2,4,6,8,13-pentazatricyclo[7.3.1.05,13]trideca-1,3,5,7,9,11-hexaene
| Molecular Formula | C15H16Cl2N6O |
|---|---|
| Molecular Weight | 366.08 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 65.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.07626 |
| Heavy Atoms | 24 |
| Complexity | 758.0 |
Chemical Identifiers
| CAS Number | 91757-88-9 |
|---|---|
| SMILES | CCCOC1=NC2=NC(=NC3=C(C=C(C(=N1)N32)Cl)Cl)N4CCCC4 |
| InChIKey | KISZPSJKHQEMPQ-UHFFFAOYSA-N |
Product Overview
7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent (CAS 91757-88-9), with molecular formula C15H16Cl2N6O and molecular weight 366.08 g/mol. IUPAC: 10,12-dichloro-3-propoxy-7-pyrrolidin-1-yl-2,4,6,8,13-pentazatricyclo[7.3.1.05,13]trideca-1,3,5,7,9,11-hexaene.
Chemical Property Profile of 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent
Property Insights of 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent
The XLogP value of 4.6 indicates that 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent. Following Lipinski's Rule of Five, 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent has 0 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 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent?
The CAS number of 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent is 91757-88-9.
What is the molecular formula of 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent?
The molecular formula of 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent is C15H16Cl2N6O.
What is the molecular weight of 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent?
The molecular weight of 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent is 366.08 g/mol.
Where can I buy 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent?
You can request a quote for 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent?
Yes, KEHONG BIO provides custom synthesis services for 7,9-dichloro-2-(1-propoxy)-5-(1-pyrrolidino)-1,3,4,6,9b-pent and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.