CBChromo1_000199
TL;DR: CBChromo1_000199 (CAS 58561-90-3) is a chemical compound with molecular formula C22H17N3O3 and molecular weight 371.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(4-nitroanilino)-phenylmethyl]quinolin-8-ol
Also Known As: CBChromo1_000199, 8-Hydroxy-7-[a-(4-nitroanilino)benzyl]quinoline, 7-(((4-Nitrophenyl)amino)(phenyl)methyl)quinolin-8-ol, 7-[(4-nitroanilino)-phenylmethyl]quinolin-8-ol, 7-((4-NITRO-PHENYLAMINO)-PHENYL-METHYL)-QUINOLIN-8-OL
| Molecular Formula | C22H17N3O3 |
|---|---|
| Molecular Weight | 371.13 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 91.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.12698 |
| Heavy Atoms | 28 |
| Complexity | 512.0 |
Chemical Identifiers
| CAS Number | 58561-90-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=C(C3=C(C=CC=N3)C=C2)O)NC4=CC=C(C=C4)[N+](=O)[O-] |
| InChIKey | NIPBFFNWSFCRBD-UHFFFAOYSA-N |
Product Overview
CBChromo1_000199 (CAS 58561-90-3), with molecular formula C22H17N3O3 and molecular weight 371.13 g/mol. IUPAC: 7-[(4-nitroanilino)-phenylmethyl]quinolin-8-ol.
Chemical Property Profile of CBChromo1_000199
Property Insights of CBChromo1_000199
The XLogP value of 4.8 indicates that CBChromo1_000199 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CBChromo1_000199. Following Lipinski's Rule of Five, CBChromo1_000199 has 2 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 CBChromo1_000199?
The CAS number of CBChromo1_000199 is 58561-90-3.
What is the molecular formula of CBChromo1_000199?
The molecular formula of CBChromo1_000199 is C22H17N3O3.
What is the molecular weight of CBChromo1_000199?
The molecular weight of CBChromo1_000199 is 371.13 g/mol.
Where can I buy CBChromo1_000199?
You can request a quote for CBChromo1_000199 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBChromo1_000199?
Yes, KEHONG BIO provides custom synthesis services for CBChromo1_000199 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.