J3.560.502I
TL;DR: J3.560.502I (CAS 797764-46-6) is a chemical compound with molecular formula C27H21ClN2OS and molecular weight 456.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-(4-chlorophenyl)-11-(4-methoxyphenyl)-15-thia-12,17-diazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,16-hexaene
Also Known As: J3.560.502I, 9-(4-chlorophenyl)-7-(4-methoxyphenyl)-6,7-dihydro-5H-benzo[h]thiazolo[2,3-b]quinazoline, 13-(4-chlorophenyl)-11-(4-methoxyphenyl)-15-thia-12,17-diazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,16-hexaene, 3-(4-Chlorophenyl)-5-(4-methoxyphenyl)-8,9-[1,3]butadieno-6,7-dihydro-5H-thiazolo[2,3-b]quinazoline, 9-(4-chlorophenyl)-7-(4-methoxyphenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazoline
| Molecular Formula | C27H21ClN2OS |
|---|---|
| Molecular Weight | 456.11 g/mol |
| LogP | 7.1642 |
| Topological Polar Surface Area | 24.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 456.10632 |
| Heavy Atoms | 32 |
| Complexity | 1291.9915 |
Chemical Identifiers
| CAS Number | 797764-46-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4CC3)N=C5N2C(=CS5)C6=CC=C(C=C6)Cl |
Product Overview
J3.560.502I (CAS 797764-46-6), with molecular formula C27H21ClN2OS and molecular weight 456.11 g/mol. IUPAC: 13-(4-chlorophenyl)-11-(4-methoxyphenyl)-15-thia-12,17-diazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,16-hexaene.
Chemical Property Profile of J3.560.502I
Property Insights of J3.560.502I
The XLogP value of 7.1642 indicates that J3.560.502I is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.83 Ų, J3.560.502I exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, J3.560.502I has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of J3.560.502I?
The CAS number of J3.560.502I is 797764-46-6.
What is the molecular formula of J3.560.502I?
The molecular formula of J3.560.502I is C27H21ClN2OS.
What is the molecular weight of J3.560.502I?
The molecular weight of J3.560.502I is 456.11 g/mol.
Where can I buy J3.560.502I?
You can request a quote for J3.560.502I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J3.560.502I?
Yes, KEHONG BIO provides custom synthesis services for J3.560.502I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.