UPCMLD0ENAT0511-8050:001
TL;DR: UPCMLD0ENAT0511-8050:001 (CAS 352564-87-5) is a chemical compound with molecular formula C28H32N2OS and molecular weight 444.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(12-cyclohexyl-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10(15),11,13-tetraen-4-yl)-2-phenylsulfanylethanone
Also Known As: UPCMLD0ENAT0511-8050:001, AI-020/37280032, 1-(12-Cyclohexyl-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10(15),11,13-tetraen-4-yl)-2-phenylsulfanylethanone, 1-(8-cyclohexyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)-2-(phenylthio)ethanone, 1-(8-CYCLOHEXYL-1,2,3A,4,5,6-HEXAHYDRO-3H-PYRAZINO[3,2,1-JK]CARBAZOL-3-YL)-2-(PHENYLSULFANYL)-1-ETHANONE
| Molecular Formula | C28H32N2OS |
|---|---|
| Molecular Weight | 444.22 g/mol |
| LogP | 6.7009 |
| Topological Polar Surface Area | 25.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 444.22354 |
| Heavy Atoms | 32 |
| Complexity | 1129.2899 |
Chemical Identifiers
| CAS Number | 352564-87-5 |
|---|---|
| SMILES | C1CCC(CC1)C2=CC3=C(C=C2)N4CCN(C5C4=C3CCC5)C(=O)CSC6=CC=CC=C6 |
Product Overview
UPCMLD0ENAT0511-8050:001 (CAS 352564-87-5), with molecular formula C28H32N2OS and molecular weight 444.22 g/mol. IUPAC: 1-(12-cyclohexyl-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10(15),11,13-tetraen-4-yl)-2-phenylsulfanylethanone.
Chemical Property Profile of UPCMLD0ENAT0511-8050:001
Property Insights of UPCMLD0ENAT0511-8050:001
The XLogP value of 6.7009 indicates that UPCMLD0ENAT0511-8050:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.24 Ų, UPCMLD0ENAT0511-8050:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT0511-8050:001 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT0511-8050:001?
The CAS number of UPCMLD0ENAT0511-8050:001 is 352564-87-5.
What is the molecular formula of UPCMLD0ENAT0511-8050:001?
The molecular formula of UPCMLD0ENAT0511-8050:001 is C28H32N2OS.
What is the molecular weight of UPCMLD0ENAT0511-8050:001?
The molecular weight of UPCMLD0ENAT0511-8050:001 is 444.22 g/mol.
Where can I buy UPCMLD0ENAT0511-8050:001?
You can request a quote for UPCMLD0ENAT0511-8050:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0511-8050:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0511-8050:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.