2R-1147
TL;DR: 2R-1147 (CAS 956573-74-3) is a chemical compound with molecular formula C32H21F3N2O3 and molecular weight 538.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-N-[3-(trifluoromethyl)phenyl]benzamide
Also Known As: 2R-1147, 4-[16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9(14),10,12-hexaen-17-yl]-N-[3-(trifluoromethyl)phenyl]benzenecarboxamide, 4-{16,18-dioxo-17-azapentacyclo[6.6.5.0^{2,7}.0^{9,14}.0^{15,19}]nonadeca-2,4,6,9(14),10,12-hexaen-17-yl}-N-[3-(trifluoromethyl)phenyl]benzamide, 4-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-N-[3-(trifluoromethyl)phenyl]benzamide
| Molecular Formula | C32H21F3N2O3 |
|---|---|
| Molecular Weight | 538.15 g/mol |
| LogP | 6.3543 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 538.15045 |
| Heavy Atoms | 40 |
| Complexity | 1597.7538 |
Chemical Identifiers
| CAS Number | 956573-74-3 |
|---|---|
| SMILES | C1=CC=C2C3C4C(C(C2=C1)C5=CC=CC=C35)C(=O)N(C4=O)C6=CC=C(C=C6)C(=O)NC7=CC=CC(=C7)C(F)(F)F |
Product Overview
2R-1147 (CAS 956573-74-3), with molecular formula C32H21F3N2O3 and molecular weight 538.15 g/mol. IUPAC: 4-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-N-[3-(trifluoromethyl)phenyl]benzamide.
Chemical Property Profile of 2R-1147
Property Insights of 2R-1147
The XLogP value of 6.3543 indicates that 2R-1147 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 2R-1147. Following Lipinski's Rule of Five, 2R-1147 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2R-1147?
The CAS number of 2R-1147 is 956573-74-3.
What is the molecular formula of 2R-1147?
The molecular formula of 2R-1147 is C32H21F3N2O3.
What is the molecular weight of 2R-1147?
The molecular weight of 2R-1147 is 538.15 g/mol.
Where can I buy 2R-1147?
You can request a quote for 2R-1147 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2R-1147?
Yes, KEHONG BIO provides custom synthesis services for 2R-1147 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.