ChemDiv2_003841
TL;DR: ChemDiv2_003841 (CAS 333774-60-0) is a chemical compound with molecular formula C19H20N6S and molecular weight 364.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,12,14,14-tetramethyl-4-pyridin-4-yl-10-thia-3,5,6,8,13-pentazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
Also Known As: ChemDiv2_003841, BAS 01024114, IDI1_002556, BIM-0033730.P001, 8,8,10,10-tetramethyl-2-(pyridin-4-yl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
| Molecular Formula | C19H20N6S |
|---|---|
| Molecular Weight | 364.15 g/mol |
| LogP | 3.5604 |
| Topological Polar Surface Area | 68.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 364.147 |
| Heavy Atoms | 26 |
| Complexity | 1139.229 |
Chemical Identifiers
| CAS Number | 333774-60-0 |
|---|---|
| SMILES | CC1(CC2=C(C(N1)(C)C)SC3=C2C4=NC(=NN4C=N3)C5=CC=NC=C5)C |
Product Overview
ChemDiv2_003841 (CAS 333774-60-0), with molecular formula C19H20N6S and molecular weight 364.15 g/mol. IUPAC: 12,12,14,14-tetramethyl-4-pyridin-4-yl-10-thia-3,5,6,8,13-pentazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene.
Chemical Property Profile of ChemDiv2_003841
Property Insights of ChemDiv2_003841
The XLogP value of 3.5604 indicates that ChemDiv2_003841 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_003841. Following Lipinski's Rule of Five, ChemDiv2_003841 has 1 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 ChemDiv2_003841?
The CAS number of ChemDiv2_003841 is 333774-60-0.
What is the molecular formula of ChemDiv2_003841?
The molecular formula of ChemDiv2_003841 is C19H20N6S.
What is the molecular weight of ChemDiv2_003841?
The molecular weight of ChemDiv2_003841 is 364.15 g/mol.
Where can I buy ChemDiv2_003841?
You can request a quote for ChemDiv2_003841 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_003841?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_003841 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.