Text Search
Structure Search

ethyl 3-{[(4-chlorophenyl)carbamoyl]methoxy}pyrido[1,2-a]indole-10-carboxylate

ethyl 3-{[(4-chlorophenyl)carbamoyl]methoxy}pyrido[1,2-a]indole-10-carboxylate

CAS: 339107-06-1

Formula: C23H19ClN2O4

SMILES: CCOC(=O)C1=C2C=CC=CN2C2=CC(OCC(=O)NC3=CC=C(Cl)C=C3)=CC=C12

IUPAC: ethyl 3-{[(4-chlorophenyl)carbamoyl]methoxy}pyrido[1,2-a]indole-10-carboxylate

InChI: InChI=1S/C23H19ClN2O4/c1-2-29-23(28)22-18-11-10-17(13-20(18)26-12-4-3-5-19(22)26)30-14-21(27)25-16-8-6-15(24)7-9-16/h3-13H,2,14H2,1H3,(H,25,27)

Composition: C (65.33%), H (4.53%), Cl (8.38%), N (6.62%), O (15.13%)

Molar Mass: 422.87

Atom Count: 49

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 422.1033348
Formal Charge 0
FSP3 0.13
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey XRNTWJKIXURABO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 116.87
Topological Polar Surface Area 69.04
Polarizability 45.63
Ring Count 4
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 339107-06-1 $51.35-$86.31$51.35$63.37$86.31
Request Quote