BAS 07414107
TL;DR: BAS 07414107 (CAS 847367-79-7) is a chemical compound with molecular formula C17H13N5O4 and molecular weight 351.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(6'-amino-5'-cyano-2-oxospiro[1H-indole-3,4'-2H-pyrano[2,3-c]pyrazole]-3'-yl)acetate
Also Known As: BAS 07414107, methyl (6'-amino-5'-cyano-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-3'-yl)acetate, methyl 2-(6'-amino-5'-cyano-2-oxo-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazol]-3'-yl)acetate, methyl 2-(6'-amino-5'-cyano-2-oxospiro[1H-indole-3,4'-2H-pyrano[2,3-c]pyrazole]-3'-yl)acetate, methyl 2-(6-amino-5-cyano-11-oxospiro[4H-pyrano[2,3-c]pyrazole-4,3'-indoline]- 3-yl)acetate
| Molecular Formula | C17H13N5O4 |
|---|---|
| Molecular Weight | 351.10 g/mol |
| LogP | 0.44968 |
| Topological Polar Surface Area | 143.12 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 351.09674 |
| Heavy Atoms | 26 |
| Complexity | 1032.0145 |
Chemical Identifiers
| CAS Number | 847367-79-7 |
|---|---|
| SMILES | COC(=O)CC1=C2C(=NN1)OC(=C(C23C4=CC=CC=C4NC3=O)C#N)N |
Product Overview
BAS 07414107 (CAS 847367-79-7), with molecular formula C17H13N5O4 and molecular weight 351.10 g/mol. IUPAC: methyl 2-(6'-amino-5'-cyano-2-oxospiro[1H-indole-3,4'-2H-pyrano[2,3-c]pyrazole]-3'-yl)acetate.
Chemical Property Profile of BAS 07414107
Property Insights of BAS 07414107
The XLogP value of 0.44968 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07414107. The TPSA of 143.12 Ų indicates high polarity, suggesting BAS 07414107 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 07414107 has 3 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 07414107?
The CAS number of BAS 07414107 is 847367-79-7.
What is the molecular formula of BAS 07414107?
The molecular formula of BAS 07414107 is C17H13N5O4.
What is the molecular weight of BAS 07414107?
The molecular weight of BAS 07414107 is 351.10 g/mol.
Where can I buy BAS 07414107?
You can request a quote for BAS 07414107 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07414107?
Yes, KEHONG BIO provides custom synthesis services for BAS 07414107 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.