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3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-2-propoxy-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxamide

3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-2-propoxy-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxamide structure

CAS No:
22688-47-7
Formula:
C19H25N3O4S
Chemical Name:
3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-2-propoxy-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxamide
Synonyms:
4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxamide,3,3-dimethyl-7-oxo-6-(2-phenylacetamido)-N-propoxy; N-Propoxy-benzylpenicillinamide; 3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-2-propoxy-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxamide;

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3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-2-propoxy-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxamide Basic Attributes

Molecular Weight：

391.48500

Exact Mass：

391.15657746 g/mol

Characteristics

PSA：

131.51000

XLogP3：

2.94370

Density：

1.32g/cm3

Boiling Point：

697.2ºC

Flash Point：

375.5ºC

Refractive Index：

1.621

Vapor Pressure：

2.75E-19mmHg at 25°C

Computed Properties

Molecular Weight:391.5
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:391.15657746
Monoisotopic Mass:391.15657746
Topological Polar Surface Area:127
Heavy Atom Count:27
Complexity:620
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-2-propoxy-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxamide

Basic Attributes
Characteristics
Computed Properties

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