Compound C18H18ClN3O2

8-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzoxazepin-3-ol

CAS: 61443-77-4

Molecular Formula	`C18H18ClN3O2`
Molecular Weight	343.8 g/mol
LogP	2.7
Topological Polar Surface Area	48.3 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	1
Exact Mass	343.10876
Heavy Atoms	24
Complexity	481.0

Chemical Identifiers

CAS Number	61443-77-4
SMILES	`CN1CCN(CC1)C2=NC3=C(C=CC(=C3)O)OC4=C2C=C(C=C4)Cl`
InChIKey	`VNJRIWXLPIYFGI-UHFFFAOYSA-N`

📖 Product Overview

Compound C18H18ClN3O2 (CAS: 61443-77-4) is a chemical compound with molecular formula C18H18ClN3O2 and molecular weight 343.8 g/mol. Its IUPAC systematic name is 8-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzoxazepin-3-ol. LogP 2.7 Topological Polar Surface Area 48.3 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 1 Exact Mass 343.10876 Heavy Atoms 24 Complexity 481.0 InChI Key: VNJRIWXLPIYFGI-UHFFFAOYSA-N. SMILES: CN1CCN(CC1)C2=NC3=C(C=CC(=C3)O)OC4=C2C=C(C=C4)Cl.

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