CID 20160
TL;DR: CID 20160 (CAS 698963-38-1) is a chemical compound with molecular formula C19H21ClFN3O and molecular weight 361.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-5-(2-fluorophenyl)-1-[3-(methylamino)propyl]-4,5-dihydro-3H-1,4-benzodiazepin-2-one
Also Known As: 7-chloro-5-(2-fluorophenyl)-1-[3-(methylamino)propyl]-4,5-dihydro-3H-1,4-benzodiazepin-2-one, 7-chloro-5-(2-fluorophenyl)-1-[3-(methylamino)propyl]-1,3,4,5-tetrahydro-2h-1,4-benzodiazepin-2-one
| Molecular Formula | C19H21ClFN3O |
|---|---|
| Molecular Weight | 361.14 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 44.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 361.1357 |
| Heavy Atoms | 25 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 698963-38-1 |
|---|---|
| SMILES | CNCCCN1C(=O)CNC(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F |
| InChIKey | LEJWDAKFODNWKP-UHFFFAOYSA-N |
Product Overview
CID 20160 (CAS 698963-38-1), with molecular formula C19H21ClFN3O and molecular weight 361.14 g/mol. IUPAC: 7-chloro-5-(2-fluorophenyl)-1-[3-(methylamino)propyl]-4,5-dihydro-3H-1,4-benzodiazepin-2-one.
Chemical Property Profile of CID 20160
Property Insights of CID 20160
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CID 20160. With a topological polar surface area (TPSA) of 44.4 Ų, CID 20160 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CID 20160 has 2 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 CID 20160?
The CAS number of CID 20160 is 698963-38-1.
What is the molecular formula of CID 20160?
The molecular formula of CID 20160 is C19H21ClFN3O.
What is the molecular weight of CID 20160?
The molecular weight of CID 20160 is 361.14 g/mol.
Where can I buy CID 20160?
You can request a quote for CID 20160 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CID 20160?
Yes, KEHONG BIO provides custom synthesis services for CID 20160 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.