BAS 01375502
TL;DR: BAS 01375502 (CAS 313382-08-0) is a chemical compound with molecular formula C16H12ClN3O4 and molecular weight 345.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6'-amino-5-chloro-5'-cyano-2'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3'-carboxylate
Also Known As: BAS 01375502, A0908/0042609, methyl 2'-amino-5-chloro-3'-cyano-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-5'-carboxylate, methyl 6'-amino-5-chloro-5'-cyano-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate, methyl 6'-amino-5-chloro-5'-cyano-2'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3'-carboxylate
| Molecular Formula | C16H12ClN3O4 |
|---|---|
| Molecular Weight | 345.05 g/mol |
| LogP | 1.70098 |
| Topological Polar Surface Area | 114.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 345.05164 |
| Heavy Atoms | 24 |
| Complexity | 897.07385 |
Chemical Identifiers
| CAS Number | 313382-08-0 |
|---|---|
| SMILES | CC1=C(C2(C3=C(C=CC(=C3)Cl)NC2=O)C(=C(O1)N)C#N)C(=O)OC |
Product Overview
BAS 01375502 (CAS 313382-08-0), with molecular formula C16H12ClN3O4 and molecular weight 345.05 g/mol. IUPAC: methyl 6'-amino-5-chloro-5'-cyano-2'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3'-carboxylate.
Chemical Property Profile of BAS 01375502
Property Insights of BAS 01375502
The XLogP value of 1.70098 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01375502. The TPSA of 114.44 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01375502. Following Lipinski's Rule of Five, BAS 01375502 has 2 hydrogen bond donor(s) and 6 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 01375502?
The CAS number of BAS 01375502 is 313382-08-0.
What is the molecular formula of BAS 01375502?
The molecular formula of BAS 01375502 is C16H12ClN3O4.
What is the molecular weight of BAS 01375502?
The molecular weight of BAS 01375502 is 345.05 g/mol.
Where can I buy BAS 01375502?
You can request a quote for BAS 01375502 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01375502?
Yes, KEHONG BIO provides custom synthesis services for BAS 01375502 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.