(5-carbamoyl-1H-imidazol-4-yl) 3-chloroadamantane-1-carboxylate

CAS: 79013-37-9

Molecular Formula	`C15H18ClN3O3`
Molecular Weight	323.77 g/mol
LogP	1.8
Topological Polar Surface Area	98.1 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	4
Exact Mass	323.10367
Heavy Atoms	22
Complexity	512.0

Chemical Identifiers

CAS Number	79013-37-9
SMILES	`C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)OC4=C(NC=N4)C(=O)N`
InChIKey	`NJSKIZPPQRQXGT-UHFFFAOYSA-N`

📖 Product Overview

(5-carbamoyl-1H-imidazol-4-yl) 3-chloroadamantane-1-carboxylate (CAS: 79013-37-9) is a chemical compound with molecular formula C15H18ClN3O3 and molecular weight 323.77 g/mol. Its IUPAC systematic name is (5-carbamoyl-1H-imidazol-4-yl) 3-chloroadamantane-1-carboxylate. LogP 1.8 Topological Polar Surface Area 98.1 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 4 Exact Mass 323.10367 Heavy Atoms 22 Complexity 512.0 InChI Key: NJSKIZPPQRQXGT-UHFFFAOYSA-N. SMILES: C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)OC4=C(NC=N4)C(=O)N.

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