A2927/0123180
TL;DR: A2927/0123180 (CAS 587002-10-6) is a chemical compound with molecular formula C21H14ClF3N4O5 and molecular weight 494.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(4-chlorophenyl)-2,4,6-trioxo-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-methoxybenzamide
Also Known As: A2927/0123180, N-[1-(4-chlorophenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-methoxybenzamide, N-(1-(4-chlorophenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl)-4-methoxybenzamide, N-[1-(4-CHLOROPHENYL)-2,4,6-TRIOXO-5-(TRIFLUOROMETHYL)-1H,2H,3H,4H,5H,6H,7H-PYRROLO[2,3-D]PYRIMIDIN-5-YL]-4-METHOXYBENZAMIDE, N-[1-(4-chlorophenyl)-2,4,6-trioxo-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-methoxybenzamide
| Molecular Formula | C21H14ClF3N4O5 |
|---|---|
| Molecular Weight | 494.06 g/mol |
| LogP | 2.3275 |
| Topological Polar Surface Area | 122.29 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 494.0605 |
| Heavy Atoms | 34 |
| Complexity | 1414.797 |
Chemical Identifiers
| CAS Number | 587002-10-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)NC2(C3=C(NC2=O)N(C(=O)NC3=O)C4=CC=C(C=C4)Cl)C(F)(F)F |
Product Overview
A2927/0123180 (CAS 587002-10-6), with molecular formula C21H14ClF3N4O5 and molecular weight 494.06 g/mol. IUPAC: N-[1-(4-chlorophenyl)-2,4,6-trioxo-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-methoxybenzamide.
Chemical Property Profile of A2927/0123180
Property Insights of A2927/0123180
The XLogP value of 2.3275 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2927/0123180. The TPSA of 122.29 Ų falls within the moderate polarity range, balancing permeability and solubility for A2927/0123180. Following Lipinski's Rule of Five, A2927/0123180 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 A2927/0123180?
The CAS number of A2927/0123180 is 587002-10-6.
What is the molecular formula of A2927/0123180?
The molecular formula of A2927/0123180 is C21H14ClF3N4O5.
What is the molecular weight of A2927/0123180?
The molecular weight of A2927/0123180 is 494.06 g/mol.
Where can I buy A2927/0123180?
You can request a quote for A2927/0123180 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2927/0123180?
Yes, KEHONG BIO provides custom synthesis services for A2927/0123180 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.