BAS 01978986
TL;DR: BAS 01978986 (CAS 357323-53-6) is a chemical compound with molecular formula C25H23N5O6S and molecular weight 521.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-(benzenesulfonyl)-3-nitroanilino]-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide
Also Known As: BAS 01978986, BIM-0006828.P001, 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide, N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[3-nitro(phenylsulfonyl)anilino]acetamide, N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-N~2~-(3-nitrophenyl)-N~2~-(phenylsulfonyl)glycinamide
| Molecular Formula | C25H23N5O6S |
|---|---|
| Molecular Weight | 521.14 g/mol |
| LogP | 3.22662 |
| Topological Polar Surface Area | 136.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 521.1369 |
| Heavy Atoms | 37 |
| Complexity | 1629.2953 |
Chemical Identifiers
| CAS Number | 357323-53-6 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CN(C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CC=C4 |
Product Overview
BAS 01978986 (CAS 357323-53-6), with molecular formula C25H23N5O6S and molecular weight 521.14 g/mol. IUPAC: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide.
Chemical Property Profile of BAS 01978986
Property Insights of BAS 01978986
The XLogP value of 3.22662 indicates that BAS 01978986 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.55 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01978986. Following Lipinski's Rule of Five, BAS 01978986 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01978986?
The CAS number of BAS 01978986 is 357323-53-6.
What is the molecular formula of BAS 01978986?
The molecular formula of BAS 01978986 is C25H23N5O6S.
What is the molecular weight of BAS 01978986?
The molecular weight of BAS 01978986 is 521.14 g/mol.
Where can I buy BAS 01978986?
You can request a quote for BAS 01978986 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01978986?
Yes, KEHONG BIO provides custom synthesis services for BAS 01978986 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.