CS-0591650
3-(Azepan-2-ylmethyl)-N-isopropylbenzo[b]thiophene-2-carboxamide hydrochloride
Manufacturer: ChemScene
CAS Number: 1361113-72-5
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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
C₁₉H₂₇ClN₂OS
Molecular Weight
366.95
Synonyms
None
SMILES
CC(C)NC(=O)C1=C(C2=CC=CC=C2S1)CC3CCCCCN3.Cl
Tpsa
41.13
Logp
4.536
H Acceptors
3
H Donors
2
Rotatable Bonds
4
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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: C₁₉H₂₇ClN₂OS
Molecular Weight: 366.95
Synonyms: None
SMILES: CC(C)NC(=O)C1=C(C2=CC=CC=C2S1)CC3CCCCCN3.Cl
Tpsa: 41.13
Logp: 4.536
H Acceptors: 3
H Donors: 2
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:
C₁₉H₂₇ClN₂OS
Molecular Weight:
366.95
Synonyms:
None
SMILES:
CC(C)NC(=O)C1=C(C2=CC=CC=C2S1)CC3CCCCCN3.Cl
Tpsa:
41.13
Logp:
4.536
H Acceptors:
3
H Donors:
2
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: C₁₅H₂₈N₂O₅
Molecular Weight: 316.39
Synonyms: None
SMILES: C[C@@H]1CN(C[C@@H](O1)C)CC2CCCCCN2.C(=O)(C(=O)O)O
Tpsa: 99.1
Logp: 0.7834
H Acceptors: 5
H Donors: 3
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:
C₁₅H₂₈N₂O₅
Molecular Weight:
316.39
Synonyms:
None
SMILES:
C[C@@H]1CN(C[C@@H](O1)C)CC2CCCCCN2.C(=O)(C(=O)O)O
Tpsa:
99.1
Logp:
0.7834
H Acceptors:
5
H Donors:
3
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: C₁₂H₉ClN₄
Molecular Weight: 244.68
Synonyms: None
SMILES: CC1=CC=CC=C1N2C3=C(C=N2)C(=NC=N3)Cl
Tpsa: 43.6
Logp: 2.77732
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:
C₁₂H₉ClN₄
Molecular Weight:
244.68
Synonyms:
None
SMILES:
CC1=CC=CC=C1N2C3=C(C=N2)C(=NC=N3)Cl
Tpsa:
43.6
Logp:
2.77732
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: C₆H₁₁NO₃
Molecular Weight: 145.16
Synonyms: None
SMILES: CN(CC(=O)O)C1COC1
Tpsa: 49.77
Logp: -0.5984
H Acceptors: 3
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:
C₆H₁₁NO₃
Molecular Weight:
145.16
Synonyms:
None
SMILES:
CN(CC(=O)O)C1COC1
Tpsa:
49.77
Logp:
-0.5984
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3