(S)-2-[BENZYL-(3-CHLORO-2-HYDROXY-PROPYL)-AMINO]-N-(4-BENZYLOXY-PHENYL)-아세트아미드
(S)-2-[Benzyl-(3-chloro-2-hydroxypropyl)amino]-N-(4-benzyloxyphenyl)acetamide
기본 정보
- CAS
777934-41-5- 표준 SMILES
O=C(CN(Cc1ccccc1)C[C@H](O)CCl)Nc1ccc(OCc2ccccc2)cc1- InChIKey
XQTPCGDEYXTYJX-HSZRJFAPSA-N- 분자식
- C25H27ClN2O3
- 평균 분자량
- 438.9 g/mol
- 단동위원소 질량
- 438.1710204
이름 및 식별자
- 우선 이름
- (S)-2-[Benzyl-(3-chloro-2-hydroxypropyl)amino]-N-(4-benzyloxyphenyl)acetamide
- IUPAC
- 2-[benzyl-[(2S)-3-chloro-2-hydroxypropyl]amino]-N-(4-phenylmethoxyphenyl)acetamide
- 현지명
- (S)-2-[BENZYL-(3-CHLORO-2-HYDROXY-PROPYL)-AMINO]-N-(4-BENZYLOXY-PHENYL)-아세트아미드
- 영어명
- (S)-2-[Benzyl-(3-chloro-2-hydroxy-propyl)-amino]-N-(4-benzyloxy-phenyl)-acetamide
- 분자식
- C25H27ClN2O3
- 분자량
- 438.95
이름 및 동의어
777934-41-5(S)-2-[Benzyl-(3-chloro-2-hydroxypropyl)amino]-N-(4-benzyloxyphenyl)acetamide2-[benzyl-[(2S)-3-chloro-2-hydroxypropyl]amino]-N-(4-phenylmethoxyphenyl)acetamide(S)-2-(Benzyl(3-chloro-2-hydroxypropyl)amino)-N-(4-(benzyloxy)phenyl)acetamide(s)-2-[benzyl-(3-chloro-2-hydroxy-propyl)-amino]-n-(4-benzyloxy-phenyl)-acetamideSCHEMBL6721691DTXSID80649613XQTPCGDEYXTYJX-HSZRJFAPSA-N2-{Benzyl-[(2S)-3-chloro-2-hydroxypropyl]-amino}-N-(4-benzyloxyphenyl)-acetamideN~2~-Benzyl-N-[4-(benzyloxy)phenyl]-N~2~-[(2S)-3-chloro-2-hydroxypropyl]glycinamide(S)-2-[BENZYL-(3-CHLORO-2-HYDROXY-PROPYL)-AMINO]-N-(4-BENZYLOXY-PHENYL)-아세트아미드2-[(3-chloro-2-hydroxypropyl)-(phenylmethyl)amino]-N-(4-phenylmethoxyphenyl)acetamide
이름 더 보기
Acetamide, 2-[[(2S)-3-chloro-2-hydroxypropyl](phenylmethyl)amino]-N-[4-(phenylmethoxy)phenyl]-
물성
구조 계산 물성
- XLogP
- 4.1
- 극성 표면적
- 61.8 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 31
- 형식 전하
- 0
- 복잡도
- 501
물리화학적 성질
- 끓는 점
- 648.6 · 648.6±55.0 °C(Predicted)
- 밀도
- 1.252 · 1.252±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 13.5 · 13.50±0.20(Predicted)
화학 및 산업
상·하류 제품 정보
상류 원료
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