Pyrimidine,3-bis(o-methoxybenzyl)-
TL;DR: Pyrimidine,3-bis(o-methoxybenzyl)- (CAS 916-32-5) is a chemical compound with molecular formula C31H39Cl2N3O2 and molecular weight 555.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[1,3-bis[(2-methoxyphenyl)methyl]-1,3-diazinan-2-yl]-N,N-bis(2-chloroethyl)-3-methylaniline
Also Known As: Pyrimidine,3-bis(o-methoxybenzyl)-, 4-[1,3-bis[(2-methoxyphenyl)methyl]-1,3-diazinan-2-yl]-N,N-bis(2-chloroethyl)-3-methylaniline, 4-[1,3-bis[(2-methoxyphenyl)methyl]-1,3-diazinan-2-yl]-N,N-b, 4-{1,3-Bis[(2-methoxyphenyl)methyl]-1,3-diazinan-2-yl}-N,N-bis(2-chloroethyl)-3-methylaniline, Benzenamine,n,n-bis(2-chloroethyl)-4-[hexahydro-1,3-bis[(2-methoxyphenyl)methyl]-2-pyrimidinyl]-3-methyl-
| Molecular Formula | C31H39Cl2N3O2 |
|---|---|
| Molecular Weight | 555.24 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 555.24194 |
| Heavy Atoms | 38 |
| Complexity | 633.0 |
Chemical Identifiers
| CAS Number | 916-32-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N(CCCl)CCCl)C2N(CCCN2CC3=CC=CC=C3OC)CC4=CC=CC=C4OC |
| InChIKey | ACDVXXSRYALLRP-UHFFFAOYSA-N |
Product Overview
Pyrimidine,3-bis(o-methoxybenzyl)- (CAS 916-32-5), with molecular formula C31H39Cl2N3O2 and molecular weight 555.24 g/mol. IUPAC: 4-[1,3-bis[(2-methoxyphenyl)methyl]-1,3-diazinan-2-yl]-N,N-bis(2-chloroethyl)-3-methylaniline.
Chemical Property Profile of Pyrimidine,3-bis(o-methoxybenzyl)-
Property Insights of Pyrimidine,3-bis(o-methoxybenzyl)-
The XLogP value of 6.7 indicates that Pyrimidine,3-bis(o-methoxybenzyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, Pyrimidine,3-bis(o-methoxybenzyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrimidine,3-bis(o-methoxybenzyl)- has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyrimidine,3-bis(o-methoxybenzyl)-?
The CAS number of Pyrimidine,3-bis(o-methoxybenzyl)- is 916-32-5.
What is the molecular formula of Pyrimidine,3-bis(o-methoxybenzyl)-?
The molecular formula of Pyrimidine,3-bis(o-methoxybenzyl)- is C31H39Cl2N3O2.
What is the molecular weight of Pyrimidine,3-bis(o-methoxybenzyl)-?
The molecular weight of Pyrimidine,3-bis(o-methoxybenzyl)- is 555.24 g/mol.
Where can I buy Pyrimidine,3-bis(o-methoxybenzyl)-?
You can request a quote for Pyrimidine,3-bis(o-methoxybenzyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrimidine,3-bis(o-methoxybenzyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrimidine,3-bis(o-methoxybenzyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.