1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine
TL;DR: 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine (CAS 51387-17-8) is a chemical compound with molecular formula C19H25Cl2N7 and molecular weight 421.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine
Also Known As: 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine, 1-[3,4-Dichlorophenyl]-3-[4-[[[1-ethyl-3-pyrrolidinyl]methyl]amino]-6-methyl-2-pyrimidinyl]guanidine
| Molecular Formula | C19H25Cl2N7 |
|---|---|
| Molecular Weight | 421.15 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 91.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 421.15485 |
| Heavy Atoms | 28 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 51387-17-8 |
|---|---|
| SMILES | CCN1CCC(C1)CNC2=NC(=NC(=C2)C)N=C(N)NC3=CC(=C(C=C3)Cl)Cl |
| InChIKey | YXNCHQHSFWLYBL-UHFFFAOYSA-N |
Product Overview
1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine (CAS 51387-17-8), with molecular formula C19H25Cl2N7 and molecular weight 421.15 g/mol. IUPAC: 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine.
Chemical Property Profile of 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine
Property Insights of 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine
The XLogP value of 3.7 indicates that 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine. Following Lipinski's Rule of Five, 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine 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 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine?
The CAS number of 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine is 51387-17-8.
What is the molecular formula of 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine?
The molecular formula of 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine is C19H25Cl2N7.
What is the molecular weight of 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine?
The molecular weight of 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine is 421.15 g/mol.
Where can I buy 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine?
You can request a quote for 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-dichlorophenyl)-2-[4-[(1-ethylpyrrolidin-3-yl)methylamino]-6-methylpyrimidin-2-yl]guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.