1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate
TL;DR: 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate (CAS 87813-70-5) is a chemical compound with molecular formula C24H33N7O4S and molecular weight 515.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[4-(2H-chromen-3-ylmethyl)piperazin-1-yl]-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine;methanesulfonic acid
Also Known As: 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate, 1-(4,6-Bis-allylamino-s-triazin-2-yl)-4-(3-chromene-3-ylmethyl)piperazine methanesulfonate, 6-[4-(2H-chromen-3-ylmethyl)piperazin-1-yl]-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine; methanesulfonic acid, Methanesulfonic acid--6-{4-[(2H-1-benzopyran-3-yl)methyl]piperazin-1-yl}-N~2~,N~4~-di(prop-2-en-1-yl)-1,3,5-triazine-2,4-diamine (1/1), RefChem:217372
| Molecular Formula | C24H33N7O4S |
|---|---|
| Molecular Weight | 515.23 g/mol |
| LogP | 2.1694 |
| Topological Polar Surface Area | 132.81 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 515.23145 |
| Heavy Atoms | 36 |
| Complexity | 1140.4875 |
Chemical Identifiers
| CAS Number | 87813-70-5 |
|---|---|
| SMILES | CS(=O)(=O)O.C=CCNC1=NC(=NC(=N1)N2CCN(CC2)CC3=CC4=CC=CC=C4OC3)NCC=C |
Product Overview
1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate (CAS 87813-70-5), with molecular formula C24H33N7O4S and molecular weight 515.23 g/mol. IUPAC: 6-[4-(2H-chromen-3-ylmethyl)piperazin-1-yl]-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine;methanesulfonic acid.
Chemical Property Profile of 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate
Property Insights of 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate
The XLogP value of 2.1694 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate. The TPSA of 132.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate. Following Lipinski's Rule of Five, 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate?
The CAS number of 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate is 87813-70-5.
What is the molecular formula of 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate?
The molecular formula of 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate is C24H33N7O4S.
What is the molecular weight of 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate?
The molecular weight of 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate is 515.23 g/mol.
Where can I buy 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate?
You can request a quote for 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Triazine-2,4-diamine, 6-(4-(2H-1-benzopyran-3-ylmethyl)-1-piperazinyl)-N,N'-di-2-propenyl-, monomethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.