CS-1046767
1,5-Benzoxazepin-4(5H)-one, 3-amino-7-bromo-5-(cyclopropylmethyl)-2,3-dihydro-, hydrochloride (1:1), (3S)-
Manufacturer: ChemScene
CAS Number: 3030959-18-0
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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
C₁₃H₁₆BrClN₂O₂
Molecular Weight
347.64
Synonyms
None
SMILES
N[C@H](C1=O)COC(C(N1CC2CC2)=C3)=CC=C3Br.Cl
Tpsa
55.56
Logp
2.3336
H Acceptors
3
H Donors
1
Rotatable Bonds
2
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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: C₁₃H₁₆BrClN₂O₂
Molecular Weight: 347.64
Synonyms: None
SMILES: N[C@H](C1=O)COC(C(N1CC2CC2)=C3)=CC=C3Br.Cl
Tpsa: 55.56
Logp: 2.3336
H Acceptors: 3
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:
C₁₃H₁₆BrClN₂O₂
Molecular Weight:
347.64
Synonyms:
None
SMILES:
N[C@H](C1=O)COC(C(N1CC2CC2)=C3)=CC=C3Br.Cl
Tpsa:
55.56
Logp:
2.3336
H Acceptors:
3
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: C₂₁H₂₅FN₂O₄S
Molecular Weight: 420.50
Synonyms: None
SMILES: N#CC1=C(NC(OC(C)(C)C)=O)SC2=C(C=CC(C3OC(C)(C(C)(C)O3)C)=C12)F
Tpsa: 80.58
Logp: 5.86168
H Acceptors: 6
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:
C₂₁H₂₅FN₂O₄S
Molecular Weight:
420.50
Synonyms:
None
SMILES:
N#CC1=C(NC(OC(C)(C)C)=O)SC2=C(C=CC(C3OC(C)(C(C)(C)O3)C)=C12)F
Tpsa:
80.58
Logp:
5.86168
H Acceptors:
6
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: C₁₀H₁₂BrClN₂O₂
Molecular Weight: 307.57
Synonyms: None
SMILES: CN1C2=CC(Br)=CC=C2OC[C@H](C1=O)N.Cl
Tpsa: 55.56
Logp: 1.5534
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₂BrClN₂O₂
Molecular Weight:
307.57
Synonyms:
None
SMILES:
CN1C2=CC(Br)=CC=C2OC[C@H](C1=O)N.Cl
Tpsa:
55.56
Logp:
1.5534
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₆F₃NO₂
Molecular Weight: 193.12
Synonyms: None
SMILES: OC1=C(OC)C=CN=C1C(F)(F)F
Tpsa: 42.35
Logp: 1.8146
H Acceptors: 3
H Donors: 1
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:
C₇H₆F₃NO₂
Molecular Weight:
193.12
Synonyms:
None
SMILES:
OC1=C(OC)C=CN=C1C(F)(F)F
Tpsa:
42.35
Logp:
1.8146
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1