UPCMLD0ENAT5762419:001
TL;DR: UPCMLD0ENAT5762419:001 (CAS 353786-71-7) is a chemical compound with molecular formula C19H17N3O3S and molecular weight 367.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-benzodioxol-5-yl)-6-methyl-N-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: UPCMLD0ENAT5762419:001, BIM-0038326.P001, 4-(1,3-benzodioxol-5-yl)-6-methyl-N-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide, 6-(1,3-benzodioxol-5-yl)-4-methyl-N-phenyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxamide, 4-(1,3-benzodioxol-5-yl)-6-methyl-N-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
| Molecular Formula | C19H17N3O3S |
|---|---|
| Molecular Weight | 367.10 g/mol |
| LogP | 2.8468 |
| Topological Polar Surface Area | 71.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 367.09906 |
| Heavy Atoms | 26 |
| Complexity | 911.5003 |
Chemical Identifiers
| CAS Number | 353786-71-7 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC3=C(C=C2)OCO3)C(=O)NC4=CC=CC=C4 |
Product Overview
UPCMLD0ENAT5762419:001 (CAS 353786-71-7), with molecular formula C19H17N3O3S and molecular weight 367.10 g/mol. IUPAC: 4-(1,3-benzodioxol-5-yl)-6-methyl-N-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of UPCMLD0ENAT5762419:001
Property Insights of UPCMLD0ENAT5762419:001
The XLogP value of 2.8468 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5762419:001. The TPSA of 71.62 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5762419:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5762419:001 has 3 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 UPCMLD0ENAT5762419:001?
The CAS number of UPCMLD0ENAT5762419:001 is 353786-71-7.
What is the molecular formula of UPCMLD0ENAT5762419:001?
The molecular formula of UPCMLD0ENAT5762419:001 is C19H17N3O3S.
What is the molecular weight of UPCMLD0ENAT5762419:001?
The molecular weight of UPCMLD0ENAT5762419:001 is 367.10 g/mol.
Where can I buy UPCMLD0ENAT5762419:001?
You can request a quote for UPCMLD0ENAT5762419:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5762419:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5762419:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.