(2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-prop-2-enylsulfanylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

CAS: 87-09-2

Molecular Formula	`C13H18N2O4S2`
Molecular Weight	330.4 g/mol
LogP	1.8
Topological Polar Surface Area	137.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	330.0708
Heavy Atoms	21
Complexity	495.0

Chemical Identifiers

CAS Number	87-09-2
SMILES	`CC1(C(N2C(S1)C(C2=O)NC(=O)CSCC=C)C(=O)O)C`
InChIKey	`QULKGELYPOJSLP-WCABBAIRSA-N`

📖 Product Overview

(2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-prop-2-enylsulfanylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (CAS: 87-09-2) is a chemical compound with molecular formula C13H18N2O4S2 and molecular weight 330.4 g/mol. Its IUPAC systematic name is (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-prop-2-enylsulfanylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid. LogP 1.8 Topological Polar Surface Area 137.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 6 Exact Mass 330.0708 Heavy Atoms 21 Complexity 495.0 InChI Key: QULKGELYPOJSLP-WCABBAIRSA-N. SMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)CSCC=C)C(=O)O)C.

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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-prop-2-enylsulfanylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.

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