ChemDiv2_004798
TL;DR: ChemDiv2_004798 (CAS 384794-05-2) is a chemical compound with molecular formula C19H24N4OS and molecular weight 356.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-5,5,13-trimethyl-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11,13,15-hexaen-15-amine
Also Known As: ChemDiv2_004798, IDI1_003513, N,N-diethyl-2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-amine, N,N-diethyl-2,8,8-trimethyl-8,10-dihydro-7H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-amine, N,N-DIETHYL-N-(2,8,8-TRIMETHYL-7,10-DIHYDRO-8H-PYRANO[3'',4'':5',6']PYRIDO[3',2':4,5]THIENO[3,2-D]PYRIMIDIN-4-YL)AMINE
| Molecular Formula | C19H24N4OS |
|---|---|
| Molecular Weight | 356.17 g/mol |
| LogP | 4.24542 |
| Topological Polar Surface Area | 51.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.16708 |
| Heavy Atoms | 25 |
| Complexity | 959.1079 |
Chemical Identifiers
| CAS Number | 384794-05-2 |
|---|---|
| SMILES | CCN(CC)C1=NC(=NC2=C1SC3=C2C=C4COC(CC4=N3)(C)C)C |
Product Overview
ChemDiv2_004798 (CAS 384794-05-2), with molecular formula C19H24N4OS and molecular weight 356.17 g/mol. IUPAC: N,N-diethyl-5,5,13-trimethyl-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11,13,15-hexaen-15-amine.
Chemical Property Profile of ChemDiv2_004798
Property Insights of ChemDiv2_004798
The XLogP value of 4.24542 indicates that ChemDiv2_004798 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.14 Ų, ChemDiv2_004798 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv2_004798 has 0 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_004798?
The CAS number of ChemDiv2_004798 is 384794-05-2.
What is the molecular formula of ChemDiv2_004798?
The molecular formula of ChemDiv2_004798 is C19H24N4OS.
What is the molecular weight of ChemDiv2_004798?
The molecular weight of ChemDiv2_004798 is 356.17 g/mol.
Where can I buy ChemDiv2_004798?
You can request a quote for ChemDiv2_004798 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_004798?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_004798 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.