ChemDiv3_003864
TL;DR: ChemDiv3_003864 (CAS 372980-07-9) is a chemical compound with molecular formula C19H22N4O2S and molecular weight 370.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-N-(oxolan-2-ylmethyl)-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: ChemDiv3_003864, IDI1_021774, BAS 04056925, BRD-A11137489-001-01-2, 8,8-dimethyl-N-(tetrahydrofuran-2-ylmethyl)-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-amine
| Molecular Formula | C19H22N4O2S |
|---|---|
| Molecular Weight | 370.15 g/mol |
| LogP | 3.6817 |
| Topological Polar Surface Area | 69.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 370.14636 |
| Heavy Atoms | 26 |
| Complexity | 978.4844 |
Chemical Identifiers
| CAS Number | 372980-07-9 |
|---|---|
| SMILES | CC1(CC2=NC3=C(C=C2CO1)C4=C(S3)C(=NC=N4)NCC5CCCO5)C |
Product Overview
ChemDiv3_003864 (CAS 372980-07-9), with molecular formula C19H22N4O2S and molecular weight 370.15 g/mol. IUPAC: 5,5-dimethyl-N-(oxolan-2-ylmethyl)-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 ChemDiv3_003864
Property Insights of ChemDiv3_003864
The XLogP value of 3.6817 indicates that ChemDiv3_003864 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.16 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_003864. Following Lipinski's Rule of Five, ChemDiv3_003864 has 1 hydrogen bond donor(s) and 7 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 ChemDiv3_003864?
The CAS number of ChemDiv3_003864 is 372980-07-9.
What is the molecular formula of ChemDiv3_003864?
The molecular formula of ChemDiv3_003864 is C19H22N4O2S.
What is the molecular weight of ChemDiv3_003864?
The molecular weight of ChemDiv3_003864 is 370.15 g/mol.
Where can I buy ChemDiv3_003864?
You can request a quote for ChemDiv3_003864 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_003864?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_003864 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.