BAS 00287192
TL;DR: BAS 00287192 (CAS 5305-86-2) is a chemical compound with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-[4-(dimethylamino)phenyl]-3-nitrobut-3-en-2-one
Also Known As: BAS 00287192, BIM-0016641.P001, (Z)-4-[4-(Dimethylamino)phenyl]-3-nitrobut-3-en-2-one, 4-(4-dimethyl-aminophenyl)-3-nitro-3-buten-2-one, 4-(4-Dimethylamino-phenyl)-3-nitro-but-3-en-2-one
| Molecular Formula | C12H14N2O3 |
|---|---|
| Molecular Weight | 234.10 g/mol |
| LogP | 1.9592 |
| Topological Polar Surface Area | 63.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.10045 |
| Heavy Atoms | 17 |
| Complexity | 445.144 |
Chemical Identifiers
| CAS Number | 5305-86-2 |
|---|---|
| SMILES | CC(=O)/C(=C/C1=CC=C(C=C1)N(C)C)/[N+](=O)[O-] |
Product Overview
BAS 00287192 (CAS 5305-86-2), with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol. IUPAC: (Z)-4-[4-(dimethylamino)phenyl]-3-nitrobut-3-en-2-one.
Chemical Property Profile of BAS 00287192
Property Insights of BAS 00287192
The XLogP value of 1.9592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00287192. The TPSA of 63.45 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00287192. Following Lipinski's Rule of Five, BAS 00287192 has 0 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 BAS 00287192?
The CAS number of BAS 00287192 is 5305-86-2.
What is the molecular formula of BAS 00287192?
The molecular formula of BAS 00287192 is C12H14N2O3.
What is the molecular weight of BAS 00287192?
The molecular weight of BAS 00287192 is 234.10 g/mol.
Where can I buy BAS 00287192?
You can request a quote for BAS 00287192 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00287192?
Yes, KEHONG BIO provides custom synthesis services for BAS 00287192 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.