BAS 01248695
TL;DR: BAS 01248695 (CAS 79476-57-6) is a chemical compound with molecular formula C17H16N4O2 and molecular weight 308.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-hydroxy-1H-indol-3-yl)imino]-2-(4-methylanilino)acetamide
Also Known As: BAS 01248695, (E)-N'-(2-oxoindolin-3-ylidene)-2-(p-tolylamino)acetohydrazide, 2-(4-methylanilino)-N'-(2-oxoindol-3-yl)acetohydrazide, A0660/0030696, 2-[(4-methylphenyl)amino]-N'-[(3E)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]acetohydrazide (non-preferred name)
| Molecular Formula | C17H16N4O2 |
|---|---|
| Molecular Weight | 308.13 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 89.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.12732 |
| Heavy Atoms | 23 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 79476-57-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NCC(=O)N=NC2=C(NC3=CC=CC=C32)O |
| InChIKey | YXTUTXXNWUFEHR-UHFFFAOYSA-N |
Product Overview
BAS 01248695 (CAS 79476-57-6), with molecular formula C17H16N4O2 and molecular weight 308.13 g/mol. IUPAC: N-[(2-hydroxy-1H-indol-3-yl)imino]-2-(4-methylanilino)acetamide.
Chemical Property Profile of BAS 01248695
Property Insights of BAS 01248695
The XLogP value of 4.1 indicates that BAS 01248695 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01248695. Following Lipinski's Rule of Five, BAS 01248695 has 3 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 01248695?
The CAS number of BAS 01248695 is 79476-57-6.
What is the molecular formula of BAS 01248695?
The molecular formula of BAS 01248695 is C17H16N4O2.
What is the molecular weight of BAS 01248695?
The molecular weight of BAS 01248695 is 308.13 g/mol.
Where can I buy BAS 01248695?
You can request a quote for BAS 01248695 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01248695?
Yes, KEHONG BIO provides custom synthesis services for BAS 01248695 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.