CS-0531783
(E)-11-(3-(Dimethylamino)propylidene)-6,11-dihydrodibenzo[b,e]thiepine 5-oxide Dosulepin Impurity
Manufacturer: ChemScene
CAS Number: 1447-71-8
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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
C₁₉H₂₁NOS
Molecular Weight
311.44
Synonyms
Dothiepin sulfoxide
SMILES
O=S1C2=C(/C(C3=C(C1)C=CC=C3)=C/CCN(C)C)C=CC=C2
Tpsa
20.31
Logp
3.6912
H Acceptors
2
H Donors
0
Rotatable Bonds
3
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₉H₂₁NOS
Molecular Weight: 311.44
Synonyms: Dothiepin sulfoxide
SMILES: O=S1C2=C(/C(C3=C(C1)C=CC=C3)=C/CCN(C)C)C=CC=C2
Tpsa: 20.31
Logp: 3.6912
H Acceptors: 2
H Donors: 0
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:
C₁₉H₂₁NOS
Molecular Weight:
311.44
Synonyms:
Dothiepin sulfoxide
SMILES:
O=S1C2=C(/C(C3=C(C1)C=CC=C3)=C/CCN(C)C)C=CC=C2
Tpsa:
20.31
Logp:
3.6912
H Acceptors:
2
H Donors:
0
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: C₂₉H₄₆O₅
Molecular Weight: 474.67
Synonyms: 16-Epidesacetylfusidic acid
SMILES: C[C@@]12[C@@]3([C@](C[C@H]([C@@]1([H])[C@@]4([C@@]([C@@H]([C@@H](CC4)O)C)([H])CC2)C)O)([H])/C([C@@H](C3)O)=C(C(O)=O)\CC/C=C(C)\C)C
Tpsa: 97.99
Logp: 5.0953
H Acceptors: 4
H Donors: 4
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₉H₄₆O₅
Molecular Weight:
474.67
Synonyms:
16-Epidesacetylfusidic acid
SMILES:
C[C@@]12[C@@]3([C@](C[C@H]([C@@]1([H])[C@@]4([C@@]([C@@H]([C@@H](CC4)O)C)([H])CC2)C)O)([H])/C([C@@H](C3)O)=C(C(O)=O)\CC/C=C(C)\C)C
Tpsa:
97.99
Logp:
5.0953
H Acceptors:
4
H Donors:
4
Rotatable Bonds:
4
Purity: 97%
MDL No: MFCD09263753
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₄F₃N₅O
Molecular Weight: 349.31
Synonyms: ent-Voriconazole
SMILES: C[C@H](C1=NC=NC=C1F)[C@](O)(C2=C(C=C(C=C2)F)F)CN3C=NC=N3
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
97%
MDL No:
MFCD09263753
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₄F₃N₅O
Molecular Weight:
349.31
Synonyms:
ent-Voriconazole
SMILES:
C[C@H](C1=NC=NC=C1F)[C@](O)(C2=C(C=C(C=C2)F)F)CN3C=NC=N3
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₅N
Molecular Weight: 243.39
Synonyms: None
SMILES: CN(C)CCC(C1)=C(CCCC)C2=C1C=CC=C2
Tpsa: 3.24
Logp: 4.1382
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₅N
Molecular Weight:
243.39
Synonyms:
None
SMILES:
CN(C)CCC(C1)=C(CCCC)C2=C1C=CC=C2
Tpsa:
3.24
Logp:
4.1382
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
6