![(E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine structure](/static/products/138/138792-95-7.png)
(E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine
TL;DR: (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine (CAS 138792-95-7) is a chemical compound with molecular formula C31H37N3S and molecular weight 483.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexyl-18-phenylsulfanyl-14,21-diazapentacyclo[12.7.0.01,6.08,13.015,20]henicosa-8(13),15,18,20-tetraen-17-imine
Also Known As: (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine
| Molecular Formula | C31H37N3S |
|---|---|
| Molecular Weight | 483.27 g/mol |
| LogP | 8.2087 |
| Topological Polar Surface Area | 27.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 483.2708 |
| Heavy Atoms | 35 |
| Complexity | 1150.9281 |
Chemical Identifiers
| CAS Number | 138792-95-7 |
|---|---|
| SMILES | C1CCC(CC1)N=C2C=C3C(=NC45N3C6=C(CCCC6)CC4CCCC5)C=C2SC7=CC=CC=C7 |
Product Overview
(E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine (CAS 138792-95-7), with molecular formula C31H37N3S and molecular weight 483.27 g/mol. IUPAC: N-cyclohexyl-18-phenylsulfanyl-14,21-diazapentacyclo[12.7.0.01,6.08,13.015,20]henicosa-8(13),15,18,20-tetraen-17-imine.
Chemical Property Profile of (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine
Property Insights of (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine
The XLogP value of 8.2087 indicates that (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.96 Ų, (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine?
The CAS number of (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine is 138792-95-7.
What is the molecular formula of (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine?
The molecular formula of (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine is C31H37N3S.
What is the molecular weight of (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine?
The molecular weight of (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine is 483.27 g/mol.
Where can I buy (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine?
You can request a quote for (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(3-(phenylthio)-6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzo[4,5]imidazo[2,1-e]acridin-2-ylidene)cyclohexanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.