CS-0542992
2-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile
Manufacturer: ChemScene
CAS Number: 438532-80-0
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₂H₈N₂O₂S
Molecular Weight
244.27
Synonyms
None
SMILES
N#CC1=C(N2C(C=CC2=O)=O)SC3=C1CCC3
Tpsa
61.17
Logp
1.53788
H Acceptors
4
H Donors
0
Rotatable Bonds
1
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 438532-80-0 | 2-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile | A2B Chem | -- |
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₈N₂O₂S
Molecular Weight: 244.27
Synonyms: None
SMILES: N#CC1=C(N2C(C=CC2=O)=O)SC3=C1CCC3
Tpsa: 61.17
Logp: 1.53788
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₈N₂O₂S
Molecular Weight:
244.27
Synonyms:
None
SMILES:
N#CC1=C(N2C(C=CC2=O)=O)SC3=C1CCC3
Tpsa:
61.17
Logp:
1.53788
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₄N₂O₅S
Molecular Weight: 358.37
Synonyms: None
SMILES: COC1=CC2=C(C=C1)SC(=N2)N3CC45C=CC(O4)C(C5C3=O)C(=O)O
Tpsa: 88.96
Logp: 1.6759
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₄N₂O₅S
Molecular Weight:
358.37
Synonyms:
None
SMILES:
COC1=CC2=C(C=C1)SC(=N2)N3CC45C=CC(O4)C(C5C3=O)C(=O)O
Tpsa:
88.96
Logp:
1.6759
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₁₇Cl₂N₃O₂
Molecular Weight: 426.30
Synonyms: None
SMILES: C1CN(CC2=C1N=C(N=C2Cl)Cl)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35
Tpsa: 55.32
Logp: 5.0906
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₁₇Cl₂N₃O₂
Molecular Weight:
426.30
Synonyms:
None
SMILES:
C1CN(CC2=C1N=C(N=C2Cl)Cl)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35
Tpsa:
55.32
Logp:
5.0906
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₁FN₂O₄S₂
Molecular Weight: 354.38
Synonyms: N-(4-FLUOROPHENYL)-4-HYDROXY-1-METHYL-2,2-DIOXO-1,2-DIHYDRO-2LAMBDA6-THIENO[3,2-C][1,2]THIAZINE-3-CARBOXAMIDE
SMILES: CN1C2=C(C(=C(S1(=O)=O)C(=O)NC3=CC=C(C=C3)F)O)SC=C2
Tpsa: 86.71
Logp: 2.5321
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₁FN₂O₄S₂
Molecular Weight:
354.38
Synonyms:
N-(4-FLUOROPHENYL)-4-HYDROXY-1-METHYL-2,2-DIOXO-1,2-DIHYDRO-2LAMBDA6-THIENO[3,2-C][1,2]THIAZINE-3-CARBOXAMIDE
SMILES:
CN1C2=C(C(=C(S1(=O)=O)C(=O)NC3=CC=C(C=C3)F)O)SC=C2
Tpsa:
86.71
Logp:
2.5321
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
2