![9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one structure](/static/products/877/877778-36-4.png)
9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one
TL;DR: 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one (CAS 877778-36-4) is a chemical compound with molecular formula C22H20ClNO4 and molecular weight 397.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-chloro-4-methoxyphenyl)-2-methyl-4,17-dioxa-6-azatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),2,8,11(15)-tetraen-16-one
Also Known As: 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one, 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
| Molecular Formula | C22H20ClNO4 |
|---|---|
| Molecular Weight | 397.11 g/mol |
| LogP | 4.60862 |
| Topological Polar Surface Area | 51.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 397.1081 |
| Heavy Atoms | 28 |
| Complexity | 1167.6361 |
Chemical Identifiers
| CAS Number | 877778-36-4 |
|---|---|
| SMILES | CC1=C2C(=CC3=C1OC(=O)C4=C3CCC4)CN(CO2)C5=CC(=C(C=C5)OC)Cl |
Product Overview
9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one (CAS 877778-36-4), with molecular formula C22H20ClNO4 and molecular weight 397.11 g/mol. IUPAC: 6-(3-chloro-4-methoxyphenyl)-2-methyl-4,17-dioxa-6-azatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),2,8,11(15)-tetraen-16-one.
Chemical Property Profile of 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one
Property Insights of 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one
The XLogP value of 4.60862 indicates that 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.91 Ų, 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-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 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one?
The CAS number of 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one is 877778-36-4.
What is the molecular formula of 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one?
The molecular formula of 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one is C22H20ClNO4.
What is the molecular weight of 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one?
The molecular weight of 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one is 397.11 g/mol.
Where can I buy 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one?
You can request a quote for 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one?
Yes, KEHONG BIO provides custom synthesis services for 9-(3-chloro-4-methoxyphenyl)-6-methyl-2,3,9,10-tetrahydro-1H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(8H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.