BAS 00874005
TL;DR: BAS 00874005 (CAS 89607-41-0) is a chemical compound with molecular formula C14H11BrN4O and molecular weight 330.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-4-(3-bromophenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Also Known As: BAS 00874005, J2.973.840H, J3.328.442J, 6-amino-4-(3-bromophenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, 6-AMINO-4-(3-BROMOPHENYL)-3-METHYL-2H,4H-PYRANO[2,3-C]PYRAZOLE-5-CARBONITRILE
| Molecular Formula | C14H11BrN4O |
|---|---|
| Molecular Weight | 330.01 g/mol |
| LogP | 2.6988 |
| Topological Polar Surface Area | 87.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 330.01163 |
| Heavy Atoms | 20 |
| Complexity | 756.77466 |
Chemical Identifiers
| CAS Number | 89607-41-0 |
|---|---|
| SMILES | CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=CC=C3)Br |
Product Overview
BAS 00874005 (CAS 89607-41-0), with molecular formula C14H11BrN4O and molecular weight 330.01 g/mol. IUPAC: 6-amino-4-(3-bromophenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile.
Chemical Property Profile of BAS 00874005
Property Insights of BAS 00874005
The XLogP value of 2.6988 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00874005. The TPSA of 87.72 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00874005. Following Lipinski's Rule of Five, BAS 00874005 has 2 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 00874005?
The CAS number of BAS 00874005 is 89607-41-0.
What is the molecular formula of BAS 00874005?
The molecular formula of BAS 00874005 is C14H11BrN4O.
What is the molecular weight of BAS 00874005?
The molecular weight of BAS 00874005 is 330.01 g/mol.
Where can I buy BAS 00874005?
You can request a quote for BAS 00874005 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00874005?
Yes, KEHONG BIO provides custom synthesis services for BAS 00874005 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.