6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone
TL;DR: 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone (CAS 413575-21-0) is a chemical compound with molecular formula C20H19N3O2 and molecular weight 333.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-(1,3,3-trimethylindol-2-ylidene)ethylideneamino]-3H-1,3-benzoxazol-2-one
Also Known As: 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone, 6-{[2-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)ethylidene]amino}-1,3-benzoxazol-2(3H)-one
| Molecular Formula | C20H19N3O2 |
|---|---|
| Molecular Weight | 333.15 g/mol |
| LogP | 4.1349 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 333.14774 |
| Heavy Atoms | 25 |
| Complexity | 1069.7349 |
Chemical Identifiers
| CAS Number | 413575-21-0 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2N(C1=CC=NC3=CC4=C(C=C3)NC(=O)O4)C)C |
Product Overview
6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone (CAS 413575-21-0), with molecular formula C20H19N3O2 and molecular weight 333.15 g/mol. IUPAC: 6-[2-(1,3,3-trimethylindol-2-ylidene)ethylideneamino]-3H-1,3-benzoxazol-2-one.
Chemical Property Profile of 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone
Property Insights of 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone
The XLogP value of 4.1349 indicates that 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone. Following Lipinski's Rule of Five, 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone has 1 hydrogen bond donor(s) and 4 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 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone?
The CAS number of 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone is 413575-21-0.
What is the molecular formula of 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone?
The molecular formula of 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone is C20H19N3O2.
What is the molecular weight of 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone?
The molecular weight of 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone is 333.15 g/mol.
Where can I buy 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone?
You can request a quote for 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone?
Yes, KEHONG BIO provides custom synthesis services for 6-[[2-(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]amino]-2(3H)-benzoxazolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.