ChemDiv1_002194
TL;DR: ChemDiv1_002194 (CAS 313382-03-5) is a chemical compound with molecular formula C15H10BrN5O2 and molecular weight 371.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6'-amino-5-bromo-3'-methyl-2-oxospiro[1H-indole-3,4'-2H-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Also Known As: ChemDiv1_002194, J2.882.782B, J3.017.551D, A0908/0042611, 6'-AMINO-5-BROMO-3'-METHYL-2-OXO-1,2-DIHYDRO-1'H-SPIRO[INDOLE-3,4'-PYRANO[2,3-C]PYRAZOLE]-5'-CARBONITRILE
| Molecular Formula | C15H10BrN5O2 |
|---|---|
| Molecular Weight | 371.00 g/mol |
| LogP | 1.8051 |
| Topological Polar Surface Area | 116.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 371.0018 |
| Heavy Atoms | 23 |
| Complexity | 955.2622 |
Chemical Identifiers
| CAS Number | 313382-03-5 |
|---|---|
| SMILES | CC1=C2C(=NN1)OC(=C(C23C4=C(C=CC(=C4)Br)NC3=O)C#N)N |
Product Overview
ChemDiv1_002194 (CAS 313382-03-5), with molecular formula C15H10BrN5O2 and molecular weight 371.00 g/mol. IUPAC: 6'-amino-5-bromo-3'-methyl-2-oxospiro[1H-indole-3,4'-2H-pyrano[2,3-c]pyrazole]-5'-carbonitrile.
Chemical Property Profile of ChemDiv1_002194
Property Insights of ChemDiv1_002194
The XLogP value of 1.8051 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_002194. The TPSA of 116.82 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_002194. Following Lipinski's Rule of Five, ChemDiv1_002194 has 3 hydrogen bond donor(s) and 5 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 ChemDiv1_002194?
The CAS number of ChemDiv1_002194 is 313382-03-5.
What is the molecular formula of ChemDiv1_002194?
The molecular formula of ChemDiv1_002194 is C15H10BrN5O2.
What is the molecular weight of ChemDiv1_002194?
The molecular weight of ChemDiv1_002194 is 371.00 g/mol.
Where can I buy ChemDiv1_002194?
You can request a quote for ChemDiv1_002194 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002194?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002194 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.