ASN 13778987
TL;DR: ASN 13778987 (CAS 879597-50-9) is a chemical compound with molecular formula C16H18N4O3S and molecular weight 346.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxamide
Also Known As: ASN 13778987, N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxamide, N-[5-(methoxymethyl)(1,3,4-thiadiazol-2-yl)][1-(2-methylphenyl)-5-oxopyrrolidi n-3-yl]carboxamide
| Molecular Formula | C16H18N4O3S |
|---|---|
| Molecular Weight | 346.11 g/mol |
| LogP | 1.98452 |
| Topological Polar Surface Area | 84.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 346.10995 |
| Heavy Atoms | 24 |
| Complexity | 761.2857 |
Chemical Identifiers
| CAS Number | 879597-50-9 |
|---|---|
| SMILES | CC1=CC=CC=C1N2CC(CC2=O)C(=O)NC3=NN=C(S3)COC |
Product Overview
ASN 13778987 (CAS 879597-50-9), with molecular formula C16H18N4O3S and molecular weight 346.11 g/mol. IUPAC: N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxamide.
Chemical Property Profile of ASN 13778987
Property Insights of ASN 13778987
The XLogP value of 1.98452 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 13778987. The TPSA of 84.42 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 13778987. Following Lipinski's Rule of Five, ASN 13778987 has 1 hydrogen bond donor(s) and 6 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 ASN 13778987?
The CAS number of ASN 13778987 is 879597-50-9.
What is the molecular formula of ASN 13778987?
The molecular formula of ASN 13778987 is C16H18N4O3S.
What is the molecular weight of ASN 13778987?
The molecular weight of ASN 13778987 is 346.11 g/mol.
Where can I buy ASN 13778987?
You can request a quote for ASN 13778987 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 13778987?
Yes, KEHONG BIO provides custom synthesis services for ASN 13778987 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.