BAS 06900231
TL;DR: BAS 06900231 (CAS 758702-71-5) is a chemical compound with molecular formula C16H14N4O4 and molecular weight 326.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-4-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Also Known As: BAS 06900231, F1765-0445, 6-amino-4-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(7-methoxybenzo[d][1,3]dioxol-5-yl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
| Molecular Formula | C16H14N4O4 |
|---|---|
| Molecular Weight | 326.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.1015 |
| Heavy Atoms | 24 |
| Complexity | 588.0 |
Chemical Identifiers
| CAS Number | 758702-71-5 |
|---|---|
| SMILES | CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC4=C(C(=C3)OC)OCO4 |
| InChIKey | LPGXZJZZSOFQSD-UHFFFAOYSA-N |
Product Overview
BAS 06900231 (CAS 758702-71-5), with molecular formula C16H14N4O4 and molecular weight 326.10 g/mol. IUPAC: 6-amino-4-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
Chemical Property Profile of BAS 06900231
Property Insights of BAS 06900231
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06900231. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06900231. Following Lipinski's Rule of Five, BAS 06900231 has 2 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 06900231?
The CAS number of BAS 06900231 is 758702-71-5.
What is the molecular formula of BAS 06900231?
The molecular formula of BAS 06900231 is C16H14N4O4.
What is the molecular weight of BAS 06900231?
The molecular weight of BAS 06900231 is 326.10 g/mol.
Where can I buy BAS 06900231?
You can request a quote for BAS 06900231 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06900231?
Yes, KEHONG BIO provides custom synthesis services for BAS 06900231 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.