1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro-
TL;DR: 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro- (CAS 22272-32-8) is a chemical compound with molecular formula C14H14ClNO2 and molecular weight 263.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(butan-2-ylamino)-3-chloronaphthalene-1,4-dione
Also Known As: 2-sec-Butylamino-3-chloro-1,4-naphthoquinone, 1, 2-(sec-butylamino)-3-chloro-, 1,4-NAPHTHOQUINONE, 2-(sec-BUTYLAMINO)-3-CHLORO-, 2-(butan-2-ylamino)-3-chloronaphthalene-1,4-dione, 3-sek.-Butylamino-2-chlor-1,4-naphthochinon
| Molecular Formula | C14H14ClNO2 |
|---|---|
| Molecular Weight | 263.07 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.07132 |
| Heavy Atoms | 18 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 22272-32-8 |
|---|---|
| SMILES | CCC(C)NC1=C(C(=O)C2=CC=CC=C2C1=O)Cl |
| InChIKey | HDXVNLIHACWOKE-UHFFFAOYSA-N |
Product Overview
1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro- (CAS 22272-32-8), with molecular formula C14H14ClNO2 and molecular weight 263.07 g/mol. IUPAC: 2-(butan-2-ylamino)-3-chloronaphthalene-1,4-dione.
Chemical Property Profile of 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro-
Property Insights of 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro-
The XLogP value of 4.1 indicates that 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.2 Ų, 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro- has 1 hydrogen bond donor(s) and 3 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 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro-?
The CAS number of 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro- is 22272-32-8.
What is the molecular formula of 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro-?
The molecular formula of 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro- is C14H14ClNO2.
What is the molecular weight of 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro-?
The molecular weight of 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro- is 263.07 g/mol.
Where can I buy 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro-?
You can request a quote for 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Naphthoquinone, 2-(sec-butylamino)-3-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.