Preparation 142
TL;DR: Preparation 142 (CAS 17799-35-8) is a chemical compound with molecular formula C21H30N5O2P and molecular weight 415.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[bis(aziridin-1-yl)phosphoryl]-5-[(4-butoxyphenyl)methyl]-2,6-dimethylpyrimidin-4-amine
Also Known As: Preparation 142, Preparation142, Phosphinic amide, P,P-bis(1-aziridinyl)-N-(5-(p-butoxybenzyl)-2,6-dimethyl-4-pyrimidinyl)-, 2,4-Dimethyl-5-(4-butoxybenzyl)pyrimid-6-ylaminophosphoric acid diethylenimide, bis-aziridin-1-yl-phosphinic acid pyridin-2-ylamide
| Molecular Formula | C21H30N5O2P |
|---|---|
| Molecular Weight | 415.21 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 70.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 415.2137 |
| Heavy Atoms | 29 |
| Complexity | 561.0 |
Chemical Identifiers
| CAS Number | 17799-35-8 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)CC2=C(N=C(N=C2NP(=O)(N3CC3)N4CC4)C)C |
| InChIKey | XHXVAJHZTIXQQD-UHFFFAOYSA-N |
Product Overview
Preparation 142 (CAS 17799-35-8), with molecular formula C21H30N5O2P and molecular weight 415.21 g/mol. IUPAC: N-[bis(aziridin-1-yl)phosphoryl]-5-[(4-butoxyphenyl)methyl]-2,6-dimethylpyrimidin-4-amine.
Chemical Property Profile of Preparation 142
Property Insights of Preparation 142
The XLogP value of 3.8 indicates that Preparation 142 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Preparation 142. Following Lipinski's Rule of Five, Preparation 142 has 1 hydrogen bond donor(s) and 7 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 Preparation 142?
The CAS number of Preparation 142 is 17799-35-8.
What is the molecular formula of Preparation 142?
The molecular formula of Preparation 142 is C21H30N5O2P.
What is the molecular weight of Preparation 142?
The molecular weight of Preparation 142 is 415.21 g/mol.
Where can I buy Preparation 142?
You can request a quote for Preparation 142 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Preparation 142?
Yes, KEHONG BIO provides custom synthesis services for Preparation 142 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.