TL;DR: 1,2,4-Triazolo(3,4-a)phthalazin-6-amine, N,N-bis(2-methoxyethyl)-3-(4-(1-methylethyloxy)phenyl)- (CAS 113628-71-0) is a chemical compound with molecular formula C24H29N5O3 and molecular weight 435.22705 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-bis(2-methoxyethyl)-3-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-amine
Also Known As: 1,2,4-Triazolo(3,4-a)phthalazin-6-amine, N,N-bis(2-methoxyethyl)-3-(4-(1-methylethyloxy)phenyl)-, N,N-Bis(2-methoxyethyl)-3-(4-isopropoxyphenyl)-1,2,4-triazolo(3,4-a)phthalazin-6-amine, N,N-bis(2-methoxyethyl)-3-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-amine, N,N-Bis(2-methoxyethyl)-3-{4-[(propan-2-yl)oxy]phenyl}[1,2,4]triazolo[3,4-a]phthalazin-6-amine, BRN 6447412
| Molecular Formula | C24H29N5O3 |
| Molecular Weight | 435.22705 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 74.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 435.22705 Da |
| Heavy Atoms | 32 |
| Complexity | 552.0 |
| SMILES | CC(C)OC1=CC=C(C=C1)C2=NN=C3N2N=C(C4=CC=CC=C43)N(CCOC)CCOC |
| InChIKey | SRMUDIQBHIZHCP-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that 1,2,4-Triazolo(3,4-a)phthalazin-6-amine, N,N-bis(2-methoxyethyl)-3-(4-(1-methylethyloxy)phenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,4-Triazolo(3,4-a)phthalazin-6-amine, N,N-bis(2-methoxyethyl)-3-(4-(1-methylethyloxy)phenyl)-. Following Lipinski's Rule of Five, 1,2,4-Triazolo(3,4-a)phthalazin-6-amine, N,N-bis(2-methoxyethyl)-3-(4-(1-methylethyloxy)phenyl)- has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,2,4-Triazolo(3,4-a)phthalazin-6-amine, N,N-bis(2-methoxyethyl)-3-(4-(1-methylethyloxy)phenyl)- is 113628-71-0.
The molecular formula of 1,2,4-Triazolo(3,4-a)phthalazin-6-amine, N,N-bis(2-methoxyethyl)-3-(4-(1-methylethyloxy)phenyl)- is C24H29N5O3.
The molecular weight of 1,2,4-Triazolo(3,4-a)phthalazin-6-amine, N,N-bis(2-methoxyethyl)-3-(4-(1-methylethyloxy)phenyl)- is 435.22705 g/mol.
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