BAS 01058340
TL;DR: BAS 01058340 (CAS 312934-95-5) is a chemical compound with molecular formula C18H12F3N5O and molecular weight 371.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(cyanomethyl)-11-(trifluoromethyl)-12,13,17-triazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(17),2,4,6,10,13,15-heptaene-14-carboxamide
Also Known As: BAS 01058340, N-(cyanomethyl)-7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazoline-10-carboxamide, N-(cyanomethyl)[7-(trifluoromethyl)(5,6,8-trihydrobenzo[h]pyrazolo[5,1-b]quina zolin-10-yl)]carboxamide
| Molecular Formula | C18H12F3N5O |
|---|---|
| Molecular Weight | 371.10 g/mol |
| LogP | 2.76708 |
| Topological Polar Surface Area | 83.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 371.0994 |
| Heavy Atoms | 27 |
| Complexity | 1110.6082 |
Chemical Identifiers
| CAS Number | 312934-95-5 |
|---|---|
| SMILES | C1CC2=C(N3C(=CC(=N3)C(=O)NCC#N)N=C2C4=CC=CC=C41)C(F)(F)F |
Product Overview
BAS 01058340 (CAS 312934-95-5), with molecular formula C18H12F3N5O and molecular weight 371.10 g/mol. IUPAC: N-(cyanomethyl)-11-(trifluoromethyl)-12,13,17-triazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(17),2,4,6,10,13,15-heptaene-14-carboxamide.
Chemical Property Profile of BAS 01058340
Property Insights of BAS 01058340
The XLogP value of 2.76708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01058340. The TPSA of 83.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01058340. Following Lipinski's Rule of Five, BAS 01058340 has 1 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 01058340?
The CAS number of BAS 01058340 is 312934-95-5.
What is the molecular formula of BAS 01058340?
The molecular formula of BAS 01058340 is C18H12F3N5O.
What is the molecular weight of BAS 01058340?
The molecular weight of BAS 01058340 is 371.10 g/mol.
Where can I buy BAS 01058340?
You can request a quote for BAS 01058340 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01058340?
Yes, KEHONG BIO provides custom synthesis services for BAS 01058340 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.