TL;DR: 3,8-Dimethyl-3-(4-methylpent-3-en-1-yl)-3,11-dihydropyrano(3,2-a)carbazol-9-ol (CAS 138876-26-3) is a chemical compound with molecular formula C23H25NO2 and molecular weight 347.18854 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,8-dimethyl-3-(4-methylpent-3-enyl)-11H-pyrano[3,2-a]carbazol-9-ol
Also Known As: Isomahanine, Pyrafoline D, Pyrayafoline D, Bisisomahanine, MEGxp0_000256
| Molecular Formula | C23H25NO2 |
| Molecular Weight | 347.18854 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 45.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.18854 Da |
| Heavy Atoms | 26 |
| Complexity | 581.0 |
| SMILES | CC1=CC2=C(C=C1O)NC3=C2C=CC4=C3C=CC(O4)(C)CCC=C(C)C |
| InChIKey | WWXYBSVWYPHUPZ-UHFFFAOYSA-N |
The XLogP value of 6.3 indicates that 3,8-Dimethyl-3-(4-methylpent-3-en-1-yl)-3,11-dihydropyrano(3,2-a)carbazol-9-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.3 Ų, 3,8-Dimethyl-3-(4-methylpent-3-en-1-yl)-3,11-dihydropyrano(3,2-a)carbazol-9-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,8-Dimethyl-3-(4-methylpent-3-en-1-yl)-3,11-dihydropyrano(3,2-a)carbazol-9-ol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3,8-Dimethyl-3-(4-methylpent-3-en-1-yl)-3,11-dihydropyrano(3,2-a)carbazol-9-ol is 138876-26-3.
The molecular formula of 3,8-Dimethyl-3-(4-methylpent-3-en-1-yl)-3,11-dihydropyrano(3,2-a)carbazol-9-ol is C23H25NO2.
The molecular weight of 3,8-Dimethyl-3-(4-methylpent-3-en-1-yl)-3,11-dihydropyrano(3,2-a)carbazol-9-ol is 347.18854 g/mol.
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