CS-0100429
(3aS,4S,6aR)-Hexahydro-2-oxo-1,3-bis(phenylmethyl)-1H-thieno[3,4-d]imidazole-4-pentanoic acid
Manufacturer: ChemScene
CAS Number: 33607-60-2
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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
C₂₄H₂₈N₂O₃S
Molecular Weight
424.56
Synonyms
cis-(-)-1,3-Dibenzylhexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-valeric Acid
SMILES
O=C(O)CCCC[C@@H]1SC[C@]([C@]1([H])N2CC3=CC=CC=C3)([H])N(CC4=CC=CC=C4)C2=O
Tpsa
60.85
Logp
4.622
H Acceptors
3
H Donors
1
Rotatable Bonds
9
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: C₂₄H₂₈N₂O₃S
Molecular Weight: 424.56
Synonyms: cis-(-)-1,3-Dibenzylhexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-valeric Acid
SMILES: O=C(O)CCCC[C@@H]1SC[C@]([C@]1([H])N2CC3=CC=CC=C3)([H])N(CC4=CC=CC=C4)C2=O
Tpsa: 60.85
Logp: 4.622
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₈N₂O₃S
Molecular Weight:
424.56
Synonyms:
cis-(-)-1,3-Dibenzylhexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-valeric Acid
SMILES:
O=C(O)CCCC[C@@H]1SC[C@]([C@]1([H])N2CC3=CC=CC=C3)([H])N(CC4=CC=CC=C4)C2=O
Tpsa:
60.85
Logp:
4.622
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
9
Purity: 98%
MDL No: MFCD28978249
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₂₀Cl₂N₂O₅
Molecular Weight: 499.34
Synonyms: None
SMILES: CN(C1=CC2=[O+]C3=C(C=CC(N(C)C)=C3)C(C4=C(C([O-])=O)C(Cl)=C(C(O)=O)C=C4Cl)=C2C=C1)C
Tpsa: 95.21
Logp: 5.0346
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
MFCD28978249
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₂₀Cl₂N₂O₅
Molecular Weight:
499.34
Synonyms:
None
SMILES:
CN(C1=CC2=[O+]C3=C(C=CC(N(C)C)=C3)C(C4=C(C([O-])=O)C(Cl)=C(C(O)=O)C=C4Cl)=C2C=C1)C
Tpsa:
95.21
Logp:
5.0346
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: MFCD18391616
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₆BrIO
Molecular Weight: 312.93
Synonyms: 2-Bromo-3-iodoanisole
SMILES: COC1=C(Br)C(I)=CC=C1
Tpsa: 9.23
Logp: 3.0623
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD18391616
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₆BrIO
Molecular Weight:
312.93
Synonyms:
2-Bromo-3-iodoanisole
SMILES:
COC1=C(Br)C(I)=CC=C1
Tpsa:
9.23
Logp:
3.0623
H Acceptors:
1
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: C₂₅H₂₀Cl₂N₂O₅
Molecular Weight: 499.34
Synonyms: None
SMILES: O=C(C1=C(C2=C3C=CC(N(C)C)=CC3=[O+]C4=C2C=CC(N(C)C)=C4)C(Cl)=C(C(O)=O)C=C1Cl)[O-]
Tpsa: 95.21
Logp: 5.0346
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₂₀Cl₂N₂O₅
Molecular Weight:
499.34
Synonyms:
None
SMILES:
O=C(C1=C(C2=C3C=CC(N(C)C)=CC3=[O+]C4=C2C=CC(N(C)C)=C4)C(Cl)=C(C(O)=O)C=C1Cl)[O-]
Tpsa:
95.21
Logp:
5.0346
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
5