ChemDiv1_024701
TL;DR: ChemDiv1_024701 (CAS 371925-69-8) is a chemical compound with molecular formula C22H28N4OS and molecular weight 396.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-13-piperidin-1-yl-8-propyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene
Also Known As: ChemDiv1_024701, 2,2-dimethyl-8-(piperidin-1-yl)-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine, 2,2-dimethyl-8-(piperidin-1-yl)-5-propyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine, 2,2-DIMETHYL-8-PIPERIDINO-5-PROPYL-1,4-DIHYDRO-2H-PYRANO[4'',3'':4',5']PYRIDO[3',2':4,5]THIENO[3,2-D]PYRIMIDINE
| Molecular Formula | C22H28N4OS |
|---|---|
| Molecular Weight | 396.20 g/mol |
| LogP | 5.0336 |
| Topological Polar Surface Area | 51.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 396.1984 |
| Heavy Atoms | 28 |
| Complexity | 1036.1104 |
Chemical Identifiers
| CAS Number | 371925-69-8 |
|---|---|
| SMILES | CCCC1=NC2=C(C3=C1COC(C3)(C)C)C4=C(S2)C(=NC=N4)N5CCCCC5 |
Product Overview
ChemDiv1_024701 (CAS 371925-69-8), with molecular formula C22H28N4OS and molecular weight 396.20 g/mol. IUPAC: 4,4-dimethyl-13-piperidin-1-yl-8-propyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene.
Chemical Property Profile of ChemDiv1_024701
Property Insights of ChemDiv1_024701
The XLogP value of 5.0336 indicates that ChemDiv1_024701 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.14 Ų, ChemDiv1_024701 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_024701 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_024701?
The CAS number of ChemDiv1_024701 is 371925-69-8.
What is the molecular formula of ChemDiv1_024701?
The molecular formula of ChemDiv1_024701 is C22H28N4OS.
What is the molecular weight of ChemDiv1_024701?
The molecular weight of ChemDiv1_024701 is 396.20 g/mol.
Where can I buy ChemDiv1_024701?
You can request a quote for ChemDiv1_024701 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_024701?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_024701 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.