ChemDiv3_003550
TL;DR: ChemDiv3_003550 (CAS 303980-20-3) 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.
5,5-dimethyl-N-(3-methylbutyl)-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_003550, IDI1_021460, BAS 02747766, BRD-K62779821-001-01-4, 8,8-dimethyl-N-(3-methylbutyl)-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-amine
| Molecular Formula | C19H24N4OS |
|---|---|
| Molecular Weight | 356.17 g/mol |
| LogP | 4.5488 |
| Topological Polar Surface Area | 59.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.16708 |
| Heavy Atoms | 25 |
| Complexity | 931.9598 |
Chemical Identifiers
| CAS Number | 303980-20-3 |
|---|---|
| SMILES | CC(C)CCNC1=NC=NC2=C1SC3=C2C=C4COC(CC4=N3)(C)C |
Product Overview
ChemDiv3_003550 (CAS 303980-20-3), with molecular formula C19H24N4OS and molecular weight 356.17 g/mol. IUPAC: 5,5-dimethyl-N-(3-methylbutyl)-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_003550
Property Insights of ChemDiv3_003550
The XLogP value of 4.5488 indicates that ChemDiv3_003550 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.93 Ų, ChemDiv3_003550 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_003550 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 ChemDiv3_003550?
The CAS number of ChemDiv3_003550 is 303980-20-3.
What is the molecular formula of ChemDiv3_003550?
The molecular formula of ChemDiv3_003550 is C19H24N4OS.
What is the molecular weight of ChemDiv3_003550?
The molecular weight of ChemDiv3_003550 is 356.17 g/mol.
Where can I buy ChemDiv3_003550?
You can request a quote for ChemDiv3_003550 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_003550?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_003550 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.