TL;DR: 1,3-Propanediol, 2-methyl-2-(((7-methyl-7H-benzo(c)carbazol-5-yl)methyl)amino)- (CAS 129026-44-4) is a chemical compound with molecular formula C22H24N2O2 and molecular weight 348.18378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-2-[(7-methylbenzo[c]carbazol-5-yl)methylamino]propane-1,3-diol
Also Known As: 1,3-Propanediol, 2-methyl-2-(((7-methyl-7H-benzo(c)carbazol-5-yl)methyl)amino)-, 2-Methyl-2-(((7-methyl-7H-benzo(c)carbazol-5-yl)methyl)amino)-1,3-propanediol, 2-methyl-2-[(7-methylbenzo[c]carbazol-5-yl)methylamino]propane-1,3-diol, 2-Methyl-2-{[(7-methyl-7H-benzo[c]carbazol-5-yl)methyl]amino}propane-1,3-diol
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C22H24N2O2 |
| Molecular Weight | 348.18378 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 57.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.18378 Da |
| Heavy Atoms | 26 |
| Complexity | 481.0 |
| SMILES | CC(CO)(CO)NCC1=CC2=C(C3=CC=CC=C31)C4=CC=CC=C4N2C |
| InChIKey | ALZPOGXTGHNNGU-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Propanediol, 2-methyl-2-(((7-methyl-7H-benzo(c)carbazol-5-yl)methyl)amino)-. With a topological polar surface area (TPSA) of 57.4 Ų, 1,3-Propanediol, 2-methyl-2-(((7-methyl-7H-benzo(c)carbazol-5-yl)methyl)amino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Propanediol, 2-methyl-2-(((7-methyl-7H-benzo(c)carbazol-5-yl)methyl)amino)- has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,3-Propanediol, 2-methyl-2-(((7-methyl-7H-benzo(c)carbazol-5-yl)methyl)amino)- is 129026-44-4.
The molecular formula of 1,3-Propanediol, 2-methyl-2-(((7-methyl-7H-benzo(c)carbazol-5-yl)methyl)amino)- is C22H24N2O2.
The molecular weight of 1,3-Propanediol, 2-methyl-2-(((7-methyl-7H-benzo(c)carbazol-5-yl)methyl)amino)- is 348.18378 g/mol.
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