2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone
TL;DR: 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone (CAS 384370-65-4) is a chemical compound with molecular formula C22H14N4O3 and molecular weight 382.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthalene-1,4-dione
Also Known As: TimTec1_005704, A2808/0118742, 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone, 2-(1H-benzotriazol-1-yl)-3-[(4-hydroxyphenyl)amino]naphthalene-1,4-dione, (2Z)-3-(1H-benzotriazol-1-yl)-4-hydroxy-2-[(4-hydroxyphenyl)imino]naphthalen-1(2H)-one
| Molecular Formula | C22H14N4O3 |
|---|---|
| Molecular Weight | 382.11 g/mol |
| LogP | 3.4968 |
| Topological Polar Surface Area | 97.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.1066 |
| Heavy Atoms | 29 |
| Complexity | 1319.4122 |
Chemical Identifiers
| CAS Number | 384370-65-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=C(C2=O)N3C4=CC=CC=C4N=N3)NC5=CC=C(C=C5)O |
Product Overview
2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone (CAS 384370-65-4), with molecular formula C22H14N4O3 and molecular weight 382.11 g/mol. IUPAC: 2-(benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthalene-1,4-dione.
Chemical Property Profile of 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone
Property Insights of 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone
The XLogP value of 3.4968 indicates that 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone. Following Lipinski's Rule of Five, 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone has 2 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-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone?
The CAS number of 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone is 384370-65-4.
What is the molecular formula of 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone?
The molecular formula of 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone is C22H14N4O3.
What is the molecular weight of 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone?
The molecular weight of 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone is 382.11 g/mol.
Where can I buy 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone?
You can request a quote for 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-1,2,3-benzotriazol-1-yl)-3-(4-hydroxyanilino)naphthoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.