10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one
TL;DR: 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one (CAS 385386-60-7) is a chemical compound with molecular formula C17H18N2O2S and molecular weight 314.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-methyl-8-propan-2-yl-14-oxa-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: 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one, 5-isopropyl-10-methyl-3,4-dihydro-1H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8(2H)-one
| Molecular Formula | C17H18N2O2S |
|---|---|
| Molecular Weight | 314.11 g/mol |
| LogP | 4.10832 |
| Topological Polar Surface Area | 55.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.1089 |
| Heavy Atoms | 22 |
| Complexity | 952.83295 |
Chemical Identifiers
| CAS Number | 385386-60-7 |
|---|---|
| SMILES | CC1=NC2=C(C(=O)O1)SC3=C2C4=C(CCCC4)C(=N3)C(C)C |
Product Overview
10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one (CAS 385386-60-7), with molecular formula C17H18N2O2S and molecular weight 314.11 g/mol. IUPAC: 15-methyl-8-propan-2-yl-14-oxa-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 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one
Property Insights of 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one
The XLogP value of 4.10832 indicates that 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.99 Ų, 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one has 0 hydrogen bond donor(s) and 5 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 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one?
The CAS number of 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one is 385386-60-7.
What is the molecular formula of 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one?
The molecular formula of 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one is C17H18N2O2S.
What is the molecular weight of 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one?
The molecular weight of 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one is 314.11 g/mol.
Where can I buy 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one?
You can request a quote for 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one?
Yes, KEHONG BIO provides custom synthesis services for 10-methyl-5-(propan-2-yl)-1,2,3,4-tetrahydro-8H-[1,3]oxazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.