Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate
TL;DR: Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate (CAS 5929-24-8) is a chemical compound with molecular formula C28H29Cl2N5O4 and molecular weight 569.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-[4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl]-6-methyl-2-phenylpyrimidine-5-carboxylate
Also Known As: Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate, propan-2-yl 4-[4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl]-6-methyl-2-phenylpyrimidine-5-carboxylate
| Molecular Formula | C28H29Cl2N5O4 |
|---|---|
| Molecular Weight | 569.16 g/mol |
| LogP | 5.70242 |
| Topological Polar Surface Area | 104.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 569.15967 |
| Heavy Atoms | 39 |
| Complexity | 1400.2008 |
Chemical Identifiers
| CAS Number | 5929-24-8 |
|---|---|
| SMILES | CC1CN(CCN1C(=O)NC2=C(C(=CC=C2)Cl)Cl)C(=O)C3=NC(=NC(=C3C(=O)OC(C)C)C)C4=CC=CC=C4 |
Product Overview
Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate (CAS 5929-24-8), with molecular formula C28H29Cl2N5O4 and molecular weight 569.16 g/mol. IUPAC: propan-2-yl 4-[4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl]-6-methyl-2-phenylpyrimidine-5-carboxylate.
Chemical Property Profile of Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate
Property Insights of Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate
The XLogP value of 5.70242 indicates that Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.73 Ų falls within the moderate polarity range, balancing permeability and solubility for Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate. Following Lipinski's Rule of Five, Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate?
The CAS number of Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate is 5929-24-8.
What is the molecular formula of Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate?
The molecular formula of Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate is C28H29Cl2N5O4.
What is the molecular weight of Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate?
The molecular weight of Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate is 569.16 g/mol.
Where can I buy Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate?
You can request a quote for Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Propan-2-yl 4-{4-[(2,3-dichlorophenyl)carbamoyl]-3-methylpiperazine-1-carbonyl}-6-methyl-2-phenylpyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.