Heptanamide, 7-isopropylthio-N-vanillyl-
TL;DR: Heptanamide, 7-isopropylthio-N-vanillyl- (CAS 101517-14-0) is a chemical compound with molecular formula C18H29NO3S and molecular weight 339.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-hydroxy-3-methoxyphenyl)methyl]-7-propan-2-ylsulfanylheptanamide
Also Known As: N-Vanillyl-7-isopropylthioheptanamide, 7-Isopropylthio-N-vanillylheptanamide, HEPTANAMIDE, 7-ISOPROPYLTHIO-N-VANILLYL-, N-[(4-hydroxy-3-methoxyphenyl)methyl]-7-propan-2-ylsulfanylheptanamide, 7-Isopropylthio-N-(4-hydroxy-3-methoxybenzyl)heptanamide
| Molecular Formula | C18H29NO3S |
|---|---|
| Molecular Weight | 339.19 g/mol |
| LogP | 4.1091 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 339.18683 |
| Heavy Atoms | 23 |
| Complexity | 477.33453 |
Chemical Identifiers
| CAS Number | 101517-14-0 |
|---|---|
| SMILES | CC(C)SCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC |
Product Overview
Heptanamide, 7-isopropylthio-N-vanillyl- (CAS 101517-14-0), with molecular formula C18H29NO3S and molecular weight 339.19 g/mol. IUPAC: N-[(4-hydroxy-3-methoxyphenyl)methyl]-7-propan-2-ylsulfanylheptanamide.
Chemical Property Profile of Heptanamide, 7-isopropylthio-N-vanillyl-
Property Insights of Heptanamide, 7-isopropylthio-N-vanillyl-
The XLogP value of 4.1091 indicates that Heptanamide, 7-isopropylthio-N-vanillyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.56 Ų, Heptanamide, 7-isopropylthio-N-vanillyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptanamide, 7-isopropylthio-N-vanillyl- has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Heptanamide, 7-isopropylthio-N-vanillyl-?
The CAS number of Heptanamide, 7-isopropylthio-N-vanillyl- is 101517-14-0.
What is the molecular formula of Heptanamide, 7-isopropylthio-N-vanillyl-?
The molecular formula of Heptanamide, 7-isopropylthio-N-vanillyl- is C18H29NO3S.
What is the molecular weight of Heptanamide, 7-isopropylthio-N-vanillyl-?
The molecular weight of Heptanamide, 7-isopropylthio-N-vanillyl- is 339.19 g/mol.
Where can I buy Heptanamide, 7-isopropylthio-N-vanillyl-?
You can request a quote for Heptanamide, 7-isopropylthio-N-vanillyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptanamide, 7-isopropylthio-N-vanillyl-?
Yes, KEHONG BIO provides custom synthesis services for Heptanamide, 7-isopropylthio-N-vanillyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.