UPCMLD0ENAT5748111:001
TL;DR: UPCMLD0ENAT5748111:001 (CAS 166671-45-0) is a chemical compound with molecular formula C23H20N4 and molecular weight 352.1688 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-methyl-3-(2-phenylethyl)-1,3,10-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-2(6),7,9,11,13,15-hexaene-8-carbonitrile
Also Known As: UPCMLD0ENAT5748111:001, F1727-0092, 7-methyl-3-(2-phenylethyl)-1,3,10-triazatetracyclo[7.7.0.0^{2,6}.0^{11,16}]hexadeca-2(6),7,9,11,13,15-hexaene-8-carbonitrile, 4-methyl-1-(2-phenylethyl)-2,3-dihydro-1H-pyrrolo[3',2':5,6]pyrido[1,2-a]benzimidazole-5-carbonitrile, 4-methyl-1-phenethyl-2,3-dihydro-1H-benzo[4,5]imidazo[1,2-a]pyrrolo[3,2-e]pyridine-5-carbonitrile
Technical Specifications
| Molecular Formula | C23H20N4 |
| Molecular Weight | 352.1688 g/mol |
| XLogP | 5.7 |
| Topological Polar Surface Area (TPSA) | 44.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.1688 Da |
| Heavy Atoms | 27 |
| Complexity | 576.0 |
| SMILES | CC1=C(C2=NC3=CC=CC=C3N2C4=C1CCN4CCC5=CC=CC=C5)C#N |
| InChIKey | PTJOMOVMIOBQPI-UHFFFAOYSA-N |
Chemical Property Profile of UPCMLD0ENAT5748111:001
Property Insights of UPCMLD0ENAT5748111:001
The XLogP value of 5.7 indicates that UPCMLD0ENAT5748111:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.3 Ų, UPCMLD0ENAT5748111:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5748111:001 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT5748111:001?
The CAS number of UPCMLD0ENAT5748111:001 is 166671-45-0.
What is the molecular formula of UPCMLD0ENAT5748111:001?
The molecular formula of UPCMLD0ENAT5748111:001 is C23H20N4.
What is the molecular weight of UPCMLD0ENAT5748111:001?
The molecular weight of UPCMLD0ENAT5748111:001 is 352.1688 g/mol.
Where can I buy UPCMLD0ENAT5748111:001?
You can request a quote for UPCMLD0ENAT5748111:001 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for UPCMLD0ENAT5748111:001?
Yes, CoreyChem provides custom synthesis services for UPCMLD0ENAT5748111:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.