2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one
TL;DR: 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one (CAS 899377-47-0) is a chemical compound with molecular formula C18H20N2O3S and molecular weight 344.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,15-trimethyl-8-propan-2-yl-5,14-dioxa-11-thia-9,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),15-pentaen-13-one
Also Known As: 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one, 5-isopropyl-2,2,10-trimethyl-1,2-dihydropyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8(4H)-one
| Molecular Formula | C18H20N2O3S |
|---|---|
| Molecular Weight | 344.12 g/mol |
| LogP | 4.08082 |
| Topological Polar Surface Area | 65.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 344.11948 |
| Heavy Atoms | 24 |
| Complexity | 1030.3278 |
Chemical Identifiers
| CAS Number | 899377-47-0 |
|---|---|
| SMILES | CC1=NC2=C(C(=O)O1)SC3=C2C4=C(COC(C4)(C)C)C(=N3)C(C)C |
Product Overview
2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one (CAS 899377-47-0), with molecular formula C18H20N2O3S and molecular weight 344.12 g/mol. IUPAC: 4,4,15-trimethyl-8-propan-2-yl-5,14-dioxa-11-thia-9,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),15-pentaen-13-one.
Chemical Property Profile of 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one
Property Insights of 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one
The XLogP value of 4.08082 indicates that 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one. Following Lipinski's Rule of Five, 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one 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 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one?
The CAS number of 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one is 899377-47-0.
What is the molecular formula of 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one?
The molecular formula of 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one is C18H20N2O3S.
What is the molecular weight of 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one?
The molecular weight of 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one is 344.12 g/mol.
Where can I buy 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one?
You can request a quote for 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one?
Yes, KEHONG BIO provides custom synthesis services for 2,2,10-trimethyl-5-(propan-2-yl)-1,4-dihydro-2H,8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-8-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.