CAS 121608-30-8 - C27H20Cl2FN3O3S
TL;DR: CAS 121608-30-8 - C27H20Cl2FN3O3S (CAS 121608-30-8) is a chemical compound with molecular formula C27H20Cl2FN3O3S and molecular weight 555.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dichlorophenyl)-5-[(4-fluorophenyl)methylidene]-3-(4-morpholin-4-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: (5Z)-1-(2,3-dichlorophenyl)-5-[(4-fluorophenyl)methylidene]-3-(4-morpholin-4-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C27H20Cl2FN3O3S |
|---|---|
| Molecular Weight | 555.06 g/mol |
| LogP | 5.7174 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 555.05865 |
| Heavy Atoms | 37 |
| Complexity | 1407.3987 |
Chemical Identifiers
| CAS Number | 121608-30-8 |
|---|---|
| SMILES | C1COCCN1C2=CC=C(C=C2)N3C(=O)C(=CC4=CC=C(C=C4)F)C(=O)N(C3=S)C5=C(C(=CC=C5)Cl)Cl |
Product Overview
CAS 121608-30-8 - C27H20Cl2FN3O3S (CAS 121608-30-8), with molecular formula C27H20Cl2FN3O3S and molecular weight 555.06 g/mol. IUPAC: 1-(2,3-dichlorophenyl)-5-[(4-fluorophenyl)methylidene]-3-(4-morpholin-4-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of CAS 121608-30-8 - C27H20Cl2FN3O3S
Property Insights of CAS 121608-30-8 - C27H20Cl2FN3O3S
The XLogP value of 5.7174 indicates that CAS 121608-30-8 - C27H20Cl2FN3O3S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.09 Ų, CAS 121608-30-8 - C27H20Cl2FN3O3S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CAS 121608-30-8 - C27H20Cl2FN3O3S has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CAS 121608-30-8 - C27H20Cl2FN3O3S?
The CAS number of CAS 121608-30-8 - C27H20Cl2FN3O3S is 121608-30-8.
What is the molecular formula of CAS 121608-30-8 - C27H20Cl2FN3O3S?
The molecular formula of CAS 121608-30-8 - C27H20Cl2FN3O3S is C27H20Cl2FN3O3S.
What is the molecular weight of CAS 121608-30-8 - C27H20Cl2FN3O3S?
The molecular weight of CAS 121608-30-8 - C27H20Cl2FN3O3S is 555.06 g/mol.
Where can I buy CAS 121608-30-8 - C27H20Cl2FN3O3S?
You can request a quote for CAS 121608-30-8 - C27H20Cl2FN3O3S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 121608-30-8 - C27H20Cl2FN3O3S?
Yes, KEHONG BIO provides custom synthesis services for CAS 121608-30-8 - C27H20Cl2FN3O3S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.