CS-1000566
N,N-Dimethyl-γ-(1-naphthalenyloxy)-3-thiophenepropanamine
Manufacturer: ChemScene
CAS Number: 116817-25-5
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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
None
SMILES
O(C1=CC=CC=2C=CC=CC12)C(C3=CSC=C3)CCN(C)C
Tpsa
12.47
Logp
4.9731
H Acceptors
3
H Donors
0
Rotatable Bonds
6
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: None
SMILES: O(C1=CC=CC=2C=CC=CC12)C(C3=CSC=C3)CCN(C)C
Tpsa: 12.47
Logp: 4.9731
H Acceptors: 3
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:
C₁₉H₂₁NOS
Molecular Weight:
311.44
Synonyms:
None
SMILES:
O(C1=CC=CC=2C=CC=CC12)C(C3=CSC=C3)CCN(C)C
Tpsa:
12.47
Logp:
4.9731
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
6
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₁₂N₂O₃S
Molecular Weight: 180.23
Synonyms: None
SMILES: O=S(=O)(O)N1CCN(C)CC1
Tpsa: 60.85
Logp: -0.9634
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₁₂N₂O₃S
Molecular Weight:
180.23
Synonyms:
None
SMILES:
O=S(=O)(O)N1CCN(C)CC1
Tpsa:
60.85
Logp:
-0.9634
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: ≥95%
MDL No: None
Storage: 4°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄₂H₂₁₆N₃₈O₄₅
Molecular Weight: 3175.46
Synonyms: None
SMILES: N=C(N)NCCC[C@@H](C(NCC(O)=O)=O)NC(CNC([C@H](CCCNC(N)=N)NC([C@H](C(C)C)NC([C@H](CC(C)C)NC([C@@H](NC([C@H](C)NC([C@H]([C@@H](C)CC)NC([C@@H](NC([C@H](CCC(O)=O)NC([C@H](CCCCN)NC([C@H](C)NC([C@H](C)NC([C@H](CCC(N)=O)NC(CNC([C@H](CCC(O)=O)NC([C@H](CC(C)C)NC([C@@H](NC([C@H](CO)NC([C@H](CO)NC([C@H](C(C)C)NC([C@H](CC(O)=O)NC([C@H](CO)NC([C@H]([C@H](O)C)NC([C@@H](NC([C@H]([C@H](O)C)NC(CNC([C@@H](N)CCC(O)=O)=O)=O)=O)CC1=CC=CC=C1)=O)=O)=O)=O)=O)=O)=O)CC2=CC=C(C=C2)O)=O)=O)=O)=O)=O)=O)=O)=O)=O)CC3=CC=CC=C3)=O)=O)=O)CC4=CNC5=CC=CC=C45)=O)=O)=O)=O)=O
Tpsa: 1357.4
Logp: -14.10536
H Acceptors: 44
H Donors: 49
Rotatable Bonds: 104
Purity:
≥95%
MDL No:
None
Storage:
4°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄₂H₂₁₆N₃₈O₄₅
Molecular Weight:
3175.46
Synonyms:
None
SMILES:
N=C(N)NCCC[C@@H](C(NCC(O)=O)=O)NC(CNC([C@H](CCCNC(N)=N)NC([C@H](C(C)C)NC([C@H](CC(C)C)NC([C@@H](NC([C@H](C)NC([C@H]([C@@H](C)CC)NC([C@@H](NC([C@H](CCC(O)=O)NC([C@H](CCCCN)NC([C@H](C)NC([C@H](C)NC([C@H](CCC(N)=O)NC(CNC([C@H](CCC(O)=O)NC([C@H](CC(C)C)NC([C@@H](NC([C@H](CO)NC([C@H](CO)NC([C@H](C(C)C)NC([C@H](CC(O)=O)NC([C@H](CO)NC([C@H]([C@H](O)C)NC([C@@H](NC([C@H]([C@H](O)C)NC(CNC([C@@H](N)CCC(O)=O)=O)=O)=O)CC1=CC=CC=C1)=O)=O)=O)=O)=O)=O)=O)CC2=CC=C(C=C2)O)=O)=O)=O)=O)=O)=O)=O)=O)=O)CC3=CC=CC=C3)=O)=O)=O)CC4=CNC5=CC=CC=C45)=O)=O)=O)=O)=O
Tpsa:
1357.4
Logp:
-14.10536
H Acceptors:
44
H Donors:
49
Rotatable Bonds:
104
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₆O₅
Molecular Weight: 370.44
Synonyms: None
SMILES: C[C@@]12[C@@]34[C@]([C@]5([C@](C)(C[C@@]3(O4)[H])[C@](C(C=O)=O)(O)[C@H](C)C5)[H])(CCC1=CC(=O)C=C2)[H]
Tpsa: 83.97
Logp: 2.1707
H Acceptors: 5
H Donors: 1
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:
C₂₂H₂₆O₅
Molecular Weight:
370.44
Synonyms:
None
SMILES:
C[C@@]12[C@@]34[C@]([C@]5([C@](C)(C[C@@]3(O4)[H])[C@](C(C=O)=O)(O)[C@H](C)C5)[H])(CCC1=CC(=O)C=C2)[H]
Tpsa:
83.97
Logp:
2.1707
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2