BRN 4340940

6,8-dibromo-3-[5-[3-(4-chloroanilino)-2-hydroxypropyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylquinazolin-4-one

CAS: 135575-63-2

Molecular Formula	`C20H16Br2ClN5O2S2`
Molecular Weight	617.8 g/mol
LogP	5.1
Topological Polar Surface Area	144.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	8
Rotatable Bonds	7
Exact Mass	616.878
Heavy Atoms	32
Complexity	703.0

Chemical Identifiers

CAS Number	135575-63-2
SMILES	`CC1=NC2=C(C=C(C=C2Br)Br)C(=O)N1C3=NN=C(S3)SCC(CNC4=CC=C(C=C4)Cl)O`
InChIKey	`RJGIFSFDSBZSEV-UHFFFAOYSA-N`

📖 Product Overview

BRN 4340940 (CAS: 135575-63-2) is a chemical compound with molecular formula C20H16Br2ClN5O2S2 and molecular weight 617.8 g/mol. Its IUPAC systematic name is 6,8-dibromo-3-[5-[3-(4-chloroanilino)-2-hydroxypropyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylquinazolin-4-one. LogP 5.1 Topological Polar Surface Area 144.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 8 Rotatable Bonds 7 Exact Mass 616.878 Heavy Atoms 32 Complexity 703.0 InChI Key: RJGIFSFDSBZSEV-UHFFFAOYSA-N. SMILES: CC1=NC2=C(C=C(C=C2Br)Br)C(=O)N1C3=NN=C(S3)SCC(CNC4=CC=C(C=C4)Cl)O.

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