(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone
TL;DR: (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone (CAS 385386-50-5) is a chemical compound with molecular formula C26H24ClN3O2 and molecular weight 445.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-(12-methyl-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10(15),11,13-tetraen-4-yl)methanone
Also Known As: (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone, [3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl](8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)methanone, [3-(2-CHLOROPHENYL)-5-METHYL-4-ISOXAZOLYL](8-METHYL-1,2,3A,4,5,6-HEXAHYDRO-3H-PYRAZINO[3,2,1-JK]CARBAZOL-3-YL)METHANONE
| Molecular Formula | C26H24ClN3O2 |
|---|---|
| Molecular Weight | 445.16 g/mol |
| LogP | 6.09994 |
| Topological Polar Surface Area | 51.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 445.1557 |
| Heavy Atoms | 32 |
| Complexity | 1383.4839 |
Chemical Identifiers
| CAS Number | 385386-50-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N3CCN(C4C3=C2CCC4)C(=O)C5=C(ON=C5C6=CC=CC=C6Cl)C |
Product Overview
(3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone (CAS 385386-50-5), with molecular formula C26H24ClN3O2 and molecular weight 445.16 g/mol. IUPAC: [3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-(12-methyl-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10(15),11,13-tetraen-4-yl)methanone.
Chemical Property Profile of (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone
Property Insights of (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone
The XLogP value of 6.09994 indicates that (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.27 Ų, (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone?
The CAS number of (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone is 385386-50-5.
What is the molecular formula of (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone?
The molecular formula of (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone is C26H24ClN3O2.
What is the molecular weight of (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone?
The molecular weight of (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone is 445.16 g/mol.
Where can I buy (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone?
You can request a quote for (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3-(2-chlorophenyl)-5-methylisoxazol-4-yl)(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.