TL;DR: Heptanamide, 7-isopropylthio- (CAS 101517-13-9) is a chemical compound with molecular formula C10H21NOS and molecular weight 203.13438 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-propan-2-ylsulfanylheptanamide
Also Known As: 7-Isopropylthioheptanamide, 7-propan-2-ylsulfanylheptanamide, HEPTANAMIDE, 7-ISOPROPYLTHIO-, 7-(Isopropylthio)heptanamide, 7-(propan-2-ylsulfanyl)heptanamide
| Molecular Formula | C10H21NOS |
| Molecular Weight | 203.13438 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 68.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 203.13438 Da |
| Heavy Atoms | 13 |
| Complexity | 137.0 |
| SMILES | CC(C)SCCCCCCC(=O)N |
| InChIKey | RNOCVYPIICITNX-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Heptanamide, 7-isopropylthio-. The TPSA of 68.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Heptanamide, 7-isopropylthio-. Following Lipinski's Rule of Five, Heptanamide, 7-isopropylthio- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Heptanamide, 7-isopropylthio- is 101517-13-9.
The molecular formula of Heptanamide, 7-isopropylthio- is C10H21NOS.
The molecular weight of Heptanamide, 7-isopropylthio- is 203.13438 g/mol.
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