BAS 00803127
TL;DR: BAS 00803127 (CAS 307339-40-8) is a chemical compound with molecular formula C16H17N3O5S and molecular weight 363.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4,5-dimethoxy-2-nitrophenyl)methylideneamino]-4,5-dimethylthiophene-3-carboxamide
Also Known As: BAS 00803127, 2-[(4,5-dimethoxy-2-nitrobenzylidene)amino]-4,5-dimethyl-3-thiophenecarboxamide, 2-[(4,5-dimethoxy-2-nitrophenyl)methylideneamino]-4,5-dimethylthiophene-3-carboxamide
| Molecular Formula | C16H17N3O5S |
|---|---|
| Molecular Weight | 363.09 g/mol |
| LogP | 3.13984 |
| Topological Polar Surface Area | 117.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 363.0889 |
| Heavy Atoms | 25 |
| Complexity | 873.1405 |
Chemical Identifiers
| CAS Number | 307339-40-8 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)N)N=CC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)C |
Product Overview
BAS 00803127 (CAS 307339-40-8), with molecular formula C16H17N3O5S and molecular weight 363.09 g/mol. IUPAC: 2-[(4,5-dimethoxy-2-nitrophenyl)methylideneamino]-4,5-dimethylthiophene-3-carboxamide.
Chemical Property Profile of BAS 00803127
Property Insights of BAS 00803127
The XLogP value of 3.13984 indicates that BAS 00803127 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.05 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00803127. Following Lipinski's Rule of Five, BAS 00803127 has 1 hydrogen bond donor(s) and 7 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 00803127?
The CAS number of BAS 00803127 is 307339-40-8.
What is the molecular formula of BAS 00803127?
The molecular formula of BAS 00803127 is C16H17N3O5S.
What is the molecular weight of BAS 00803127?
The molecular weight of BAS 00803127 is 363.09 g/mol.
Where can I buy BAS 00803127?
You can request a quote for BAS 00803127 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00803127?
Yes, KEHONG BIO provides custom synthesis services for BAS 00803127 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.