ChemDiv1_021398
TL;DR: ChemDiv1_021398 (CAS 372175-43-4) is a chemical compound with molecular formula C24H26N6O2S and molecular weight 462.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-4,4-dimethyl-8-morpholin-4-yl-5-oxa-11-thia-9,14,15,16-tetrazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-amine
Also Known As: ChemDiv1_021398, (2,2-dimethyl-5-morpholin-4-yl(1,2-dihydro-4H-pyrano[4'',3''-4',5']pyridino[3' ,2'-4,5]thiopheno[2,3-e]1,2,3-triazin-8-yl))benzylamine, N-benzyl-2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-8-amine, N-benzyl-2,2-dimethyl-5-morpholino-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-8-amine
| Molecular Formula | C24H26N6O2S |
|---|---|
| Molecular Weight | 462.18 g/mol |
| LogP | 3.9345 |
| Topological Polar Surface Area | 85.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 462.1838 |
| Heavy Atoms | 33 |
| Complexity | 1317.2864 |
Chemical Identifiers
| CAS Number | 372175-43-4 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C(=NC3=C2C4=C(S3)C(=NN=N4)NCC5=CC=CC=C5)N6CCOCC6)C |
Product Overview
ChemDiv1_021398 (CAS 372175-43-4), with molecular formula C24H26N6O2S and molecular weight 462.18 g/mol. IUPAC: N-benzyl-4,4-dimethyl-8-morpholin-4-yl-5-oxa-11-thia-9,14,15,16-tetrazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-amine.
Chemical Property Profile of ChemDiv1_021398
Property Insights of ChemDiv1_021398
The XLogP value of 3.9345 indicates that ChemDiv1_021398 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.29 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_021398. Following Lipinski's Rule of Five, ChemDiv1_021398 has 1 hydrogen bond donor(s) and 9 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 ChemDiv1_021398?
The CAS number of ChemDiv1_021398 is 372175-43-4.
What is the molecular formula of ChemDiv1_021398?
The molecular formula of ChemDiv1_021398 is C24H26N6O2S.
What is the molecular weight of ChemDiv1_021398?
The molecular weight of ChemDiv1_021398 is 462.18 g/mol.
Where can I buy ChemDiv1_021398?
You can request a quote for ChemDiv1_021398 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_021398?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_021398 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.