UPCMLD0ENAT5747526:001
TL;DR: UPCMLD0ENAT5747526:001 (CAS 845985-43-5) is a chemical compound with molecular formula C19H20N4 and molecular weight 304.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-prop-2-enyl-1-(propylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: UPCMLD0ENAT5747526:001, F1616-0059, 2-allyl-3-methyl-1-(propylamino)benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 11-methyl-12-(prop-2-en-1-yl)-13-(propylamino)-1,8-diazatricyclo[7.4.0.0^{2,7}]trideca-2(7),3,5,8,10,12-hexaene-10-carbonitrile, 3-methyl-2-prop-2-enyl-1-(propylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile
| Molecular Formula | C19H20N4 |
|---|---|
| Molecular Weight | 304.17 g/mol |
| LogP | 4.218 |
| Topological Polar Surface Area | 53.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.1688 |
| Heavy Atoms | 23 |
| Complexity | 928.0736 |
Chemical Identifiers
| CAS Number | 845985-43-5 |
|---|---|
| SMILES | CCCNC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CC=C |
Product Overview
UPCMLD0ENAT5747526:001 (CAS 845985-43-5), with molecular formula C19H20N4 and molecular weight 304.17 g/mol. IUPAC: 3-methyl-2-prop-2-enyl-1-(propylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of UPCMLD0ENAT5747526:001
Property Insights of UPCMLD0ENAT5747526:001
The XLogP value of 4.218 indicates that UPCMLD0ENAT5747526:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.12 Ų, UPCMLD0ENAT5747526:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5747526:001 has 1 hydrogen bond donor(s) and 3 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 UPCMLD0ENAT5747526:001?
The CAS number of UPCMLD0ENAT5747526:001 is 845985-43-5.
What is the molecular formula of UPCMLD0ENAT5747526:001?
The molecular formula of UPCMLD0ENAT5747526:001 is C19H20N4.
What is the molecular weight of UPCMLD0ENAT5747526:001?
The molecular weight of UPCMLD0ENAT5747526:001 is 304.17 g/mol.
Where can I buy UPCMLD0ENAT5747526:001?
You can request a quote for UPCMLD0ENAT5747526:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5747526:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5747526:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.